Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCOA1 | Q15788 | 1/20 | 0.59 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.59 |
| ▸ | ABL1 | P00519 | 1/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.58 |
| ▸ | BCR | P11274 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.56 |
| ▸ | SYK | P43405 | 1/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.54 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.54 |
| ▸ | LTA4H | P09960 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7610761 | 0.94 | ABL1 (0.60) | NCOA1NCOA3ABL1ABCB1BCR | |
| SCHEMBL2097515 | 0.91 | ABL1 (0.58) | NCOA1NCOA3ABL1ABCB1BCR | |
| SCHEMBL11779256 | 0.91 | NCOA1 (0.75) | NCOA1NCOA3ABL1ABCB1BCR | |
| SCHEMBL2097513 | 0.91 | PTGS2 (0.53) | NCOA1NCOA3ABL1ABCB1BCR | |
| SCHEMBL6099374 | 0.88 | NCOA1 (0.51) | NCOA1NCOA3ABL1ABCB1BCR | |
| SCHEMBL1704521 | 0.88 | ABL1 (0.62) | ABL1ABCB1BCRALDH1A1HTT | |
| SCHEMBL7610753 | 0.86 | ALDH1A1 (0.59) | NCOA1NCOA3ABL1ABCB1BCR | |
| SCHEMBL10711068 | 0.83 | NCOA1 (0.69) | NCOA1NCOA3ALDH1A1HTTMAPK1 | |
| SCHEMBL9208935 | 0.83 | NCOA1 (0.75) | NCOA1NCOA3ALDH1A1HTTMAPK1 | |
| SCHEMBL12715050 | 0.83 | ABL1 (0.79) | ABL1ABCB1BCRPTGS2SYK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0863755-A4 | ANTITHROMBOTIC DIAMINES | LILLY CO ELI (US) | 1999-01-20 | — | — | EP | disclosed |
| EP-0863755-A1 | ANTITHROMBOTIC DIAMINES | ELI LILLY AND COMPANY (US) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997025033-A1 | ANTITHROMBOTIC DIAMINES | ELI LILLY AND COMPANY (US) | 1997-07-17 | — | — | WO | disclosed |