Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.67 |
| ▸ | NPC1 | O15118 | 6/20 | 0.59 |
| ▸ | RAB9A | P51151 | 6/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.49 |
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL505353 | 0.85 | CYP2C19 (0.69) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29808973 | 0.85 | CYP2C19 (0.69) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL110042 | 0.83 | POLB (0.72) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27819891 | 0.83 | POLB (0.72) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29437050 | 0.83 | POLB (0.72) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6689158 | 0.82 | ALDH1A1 (0.74) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11055851 | 0.82 | POLB (0.70) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9470786 | 0.82 | CYP2C19 (0.70) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL639707 | 0.82 | CYP2C19 (0.65) | CYP2C19POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14618040 | 0.82 | CYP2C19 (0.65) | CYP2C19POLBNPC1RAB9ASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0114734-B1 | PYRIDINYLMETHYLAMINO-ARYLIC ACIDS | THE UPJOHN COMPANY (US) | 1987-05-13 | — | — | EP | claimed |
| EP-0104727-B1 | PYRIDINYL-SUBSTITUTED BENZIMIDAZOLES AND QUINOXALINES | THE UPJOHN COMPANY (US) | 1986-12-03 | — | — | EP | claimed |
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |
| EP-0114734-B1 | PYRIDINYLMETHYLAMINO-ARYLIC ACIDS | THE UPJOHN COMPANY (US) | 1987-05-13 | — | — | EP | disclosed |
| EP-0104727-B1 | PYRIDINYL-SUBSTITUTED BENZIMIDAZOLES AND QUINOXALINES | THE UPJOHN COMPANY (US) | 1986-12-03 | — | — | EP | disclosed |
| US-3936462-A | CNS DEPRESSANT, ANALGESIC | STERLING DRUG INC. (US) | 1976-02-03 | — | — | US | disclosed |