Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TTK | P33981 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.36 |
| ▸ | CCNK | O75909 | 3/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.36 |
| ▸ | CDK2 | P24941 | 3/20 | 0.36 |
| ▸ | CDK9 | P50750 | 3/20 | 0.36 |
| ▸ | CDK12 | Q9NYV4 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL25436608 | 0.90 | CCNK (0.39) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| SCHEMBL1255259 | 0.77 | KDM4E (0.40) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| SCHEMBL10395724 | 0.76 | MAPK8 (0.44) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| SCHEMBL31295161 | 0.76 | MAPK8 (0.44) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| SCHEMBL2978037 | 0.74 | KDM4E (0.42) | KDM4EHTR2AALDH1A1PARP1 | |
| SCHEMBL1255261 | 0.74 | KDM4E (0.40) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| SCHEMBL31358121 | 0.74 | HTR2A (0.51) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| SCHEMBL7714021 | 0.74 | HTR2A (0.51) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| SCHEMBL31295238 | 0.73 | DRD2 (0.52) | KDM4EGAAPDPK1CYP3A4HTR2A | |
| Hydrochloric Acid SCHEMBL3149408 | 0.73 | KDM4E (0.44) | KDM4EALDH1A1PARP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5874435-A | PSYCHOLOGICAL DISORDERS; ANALGESICS | HOECHST MARION ROUSSEL, INC. (US) | 1999-02-23 | — | — | US | disclosed |