Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
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 SCHEMBL9878496 | 0.80 | SLC2A1 (0.55) | NPC1RAB9ALRRK2LMNASMN1; SMN2 | |
| SCHEMBL13750837 | 0.80 | HTT (0.59) | NPC1RAB9ALRRK2LMNASMN1; SMN2 | |
| SCHEMBL9879432 | 0.79 | NPC1 (0.46) | NPC1RAB9ALRRK2LMNASMN1; SMN2 | |
| SCHEMBL9878650 | 0.79 | NPC1 (0.46) | NPC1RAB9ALRRK2LMNASMN1; SMN2 | |
| SCHEMBL10939229 | 0.79 | TSHR (0.67) | NPC1RAB9ALRRK2LMNASMN1; SMN2 | |
| SCHEMBL9878662 | 0.78 | NPC1 (0.45) | NPC1RAB9ALRRK2LMNASMN1; SMN2 | |
| SCHEMBL9776681 | 0.78 | SMN1; SMN2 (0.67) | NPC1RAB9ALMNASMN1; SMN2PKM | |
| Hydrochloric Acid SCHEMBL9776675 | 0.76 | SMN1; SMN2 (0.69) | NPC1RAB9ALMNASMN1; SMN2PKM | |
| Hydrochloric Acid SCHEMBL9878892 | 0.75 | SLC2A1 (0.68) | NPC1RAB9ALRRK2LMNASMN1; SMN2 | |
| SCHEMBL9878156 | 0.74 | CCNA2 (0.59) | NPC1RAB9ALRRK2LMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991018887-A1 | DIAMINOPYRIMIDINE COMPOUNDS | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1991-12-12 | — | — | WO | disclosed |