Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | BPTF | Q12830 | 1/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.41 |
| ▸ | CCNK | O75909 | 1/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CDK7 | P50613 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
| ▸ | CCNH | P51946 | 1/20 | 0.41 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.41 |
| ▸ | CDK12 | Q9NYV4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7468744 | 1.00 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL7474491 | 0.89 | KDM4E (0.43) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL7469825 | 0.89 | MEN1 (0.41) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL7462642 | 0.89 | MEN1 (0.41) | KDM4ENPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL382924 | 0.88 | ALDH1A1 (0.48) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL7473696 | 0.83 | OPRK1 (0.42) | KDM4EALDH1A1ROCK2ROCK1CDC42BPB | |
| SCHEMBL7468715 | 0.80 | RPS6KB1 (0.37) | KDM4ENPC1RAB9ANPSR1ALDH1A1 | |
| SCHEMBL6507428 | 0.79 | KDM4E (0.46) | CYP1A2CYP3A4KDM4ENPC1RAB9A | |
| SCHEMBL7468740 | 0.79 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL7470496 | 0.79 | DPP4 (0.52) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1227083-A1 | 3-AMINOPIPERIDINE DERIVATIVES AS INTEGRIN $g(a)v$g(b)3 ANTAGONISTS | MEIJI SEIKA KAISHA LTD. (JP) | 2002-07-31 | — | — | EP | disclosed |