Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | SCD | O00767 | 2/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | TOP1 | P11387 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.31 |
| ▸ | PIK3R2 | O00459 | 2/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8917175 | 0.83 | DHODH (0.38) | DHODHSMN1; SMN2ALDH1A1GAANPC1 | |
| SCHEMBL8917381 | 0.75 | ALDH1A1 (0.45) | DHODHSMN1; SMN2ALDH1A1GAANPC1 | |
| SCHEMBL8916681 | 0.74 | ITGB1 (0.44) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL8830164 | 0.72 | KDM4E (0.43) | SMN1; SMN2ALDH1A1CXCL8NPC1RAB9A | |
| SCHEMBL8830304 | 0.69 | GRIK1 (0.39) | SMN1; SMN2ALDH1A1GAACXCL8NPC1 | |
| SCHEMBL11210924 | 0.69 | NPC1 (0.44) | ALDH1A1GAANPC1MAPTTSHR | |
| Loviride SCHEMBL29456999 | 0.68 | ALOX15 (0.39) | SMN1; SMN2ALDH1A1GAANPC1RAB9A | |
| Loviride SCHEMBL29457001 | 0.68 | ALOX15 (0.39) | SMN1; SMN2ALDH1A1GAANPC1RAB9A | |
| Loviride SCHEMBL247782 | 0.68 | ALOX15 (0.39) | SMN1; SMN2ALDH1A1GAANPC1RAB9A | |
| Loviride SCHEMBL247781 | 0.68 | ALOX15 (0.39) | SMN1; SMN2ALDH1A1GAANPC1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1034074-C | Heterocycle-substituted benzenemethanamine derivatives | JANSSEN PHARMACEUTICA NV (BE) | 1997-02-19 | — | — | CN | claimed |
| US-5604230-A | USEFUL IN INHIBITING THE REPLICATION OF HIV | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-02-18 | — | — | US | claimed |
| EP-0620811-A1 | HETEROCYCLE-SUBSTITUTED BENZYLAMINE DERIVATIVES AS ANTIRETROVIRAL COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 1994-10-26 | — | — | EP | claimed |
| WO-1993013069-A1 | HETEROCYCLE-SUBSTITUTED BENZYLAMINE DERIVATIVES AS ANTIRETROVIRAL COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-07-08 | — | — | WO | claimed |
| CN-1073942-A | The benzenemethanamine derivatives of heterocyclic substituted | JANSSEN PHARMACEUTICA NV (BE) | 1993-07-07 | — | — | CN | claimed |
| CN-1034074-C | Heterocycle-substituted benzenemethanamine derivatives | JANSSEN PHARMACEUTICA NV (BE) | 1997-02-19 | — | — | CN | disclosed |
| US-5604230-A | USEFUL IN INHIBITING THE REPLICATION OF HIV | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-02-18 | — | — | US | disclosed |
| US-5587387-A | ANTIRETROVIRAL COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-12-24 | — | — | US | disclosed |
| US-5552430-A | ANTIRETROVIRAL COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-09-03 | — | — | US | disclosed |
| US-5550135-A | ANTIRETROVIRAL AGENTS; TREATING HUMAN IMMUNODEFICIENCY VIRUS INFECTIONS | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-08-27 | — | — | US | disclosed |
| US-5541215-A | ANTIRETROVIRAL COMPOUNDS; TREATING HIV INFECTIONS | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-07-30 | — | — | US | disclosed |
| US-5480997-A | VIRICIDE FOR HIV | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-01-02 | — | — | US | disclosed |
| EP-0620811-A1 | HETEROCYCLE-SUBSTITUTED BENZYLAMINE DERIVATIVES AS ANTIRETROVIRAL COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 1994-10-26 | — | — | EP | disclosed |
| WO-1993013069-A1 | HETEROCYCLE-SUBSTITUTED BENZYLAMINE DERIVATIVES AS ANTIRETROVIRAL COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-07-08 | — | — | WO | disclosed |
| CN-1073942-A | The benzenemethanamine derivatives of heterocyclic substituted | JANSSEN PHARMACEUTICA NV (BE) | 1993-07-07 | — | — | CN | disclosed |