Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.58 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.44 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.41 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.41 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5038000 | 0.79 | ALDH1A1 (0.49) | ABCB1ABCC1ALDH1A1TDP1CYP19A1 | |
| SCHEMBL7803368 | 0.74 | TDP1 (0.62) | ABCB1ABCC1ALDH1A1TDP1 | |
| SCHEMBL7568041 | 0.73 | IKBKB (0.57) | IKBKBCRHBPCRHR2CYP11B1CYP11B2 | |
| SCHEMBL2096573 | 0.73 | PDE4B (0.55) | IKBKBHPRT1ALDH1A1SQOR | |
| SCHEMBL28501038 | 0.72 | CRHBP (0.51) | IKBKBCRHBPCRHR2ABCB1ABCC1 | |
| SCHEMBL12312167 | 0.72 | KMT2A (0.58) | CYP11B1CYP11B2ALDH1A1TDP1 | |
| SCHEMBL3787884 | 0.71 | HSPB1 (0.44) | CRHBPCRHR2ALDH1A1TDP1 | |
| SCHEMBL12325398 | 0.71 | PDE4B (0.56) | IKBKBALDH1A1SQOR | |
| SCHEMBL15875693 | 0.70 | ALDH1A1 (0.67) | CYP11B1CYP11B2ALDH1A1TDP1CYP19A1 | |
| SCHEMBL2235025 | 0.70 | ALDH1A1 (0.71) | CYP11B1CYP11B2ALDH1A1TDP1CYP19A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0885193-A1 | TRIARYL COMPOUNDS | Novartis AG (CH) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997032853-A1 | TRIARYL COMPOUNDS | NOVARTIS AG (CH) | 1997-09-12 | — | — | WO | disclosed |