Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.37 |
| ▸ | CA1 | P00915 | 7/20 | 0.37 |
| ▸ | CA9 | Q16790 | 5/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20750587 | 0.73 | CA2 (0.37) | CA2CA1CA9MAPK1CA6 | |
| SCHEMBL22295297 | 0.73 | ALDH1A1 (0.35) | CA2CA1CA6CA12CA4 | |
| SCHEMBL28268911 | 0.70 | CA2 (0.40) | CA2CA1CA9MAPK1CA6 | |
| SCHEMBL30688531 | 0.70 | AURKA (0.41) | MAPK1HPGDKDM4EALDH1A1 | |
| SCHEMBL30688485 | 0.69 | HTR5A (0.32) | — | |
| SCHEMBL8470060 | 0.69 | GABRA1 (0.36) | MAPK1CYP2C9LMNAKDM4E | |
| SCHEMBL21121137 | 0.69 | MEN1 (0.37) | LMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL31285864 | 0.67 | CA2 (0.40) | CA2CA1CA9MAPK1CA6 | |
| SCHEMBL20789927 | 0.66 | PNMT (0.43) | CA2CA1CA9MAPK1CA6 | |
| SCHEMBL4526375 | 0.66 | CA1 (0.37) | CA2CA1CA9MAPK1CA12 |
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-3074389-A1 | QUINOLINE DERIVATIVES AS BROMODOMAIN INHIBITORS | Gilead Sciences, Inc. (US) | 2016-10-05 | — | — | EP | claimed |
| WO-2015080707-A1 | QUINOLINE DERIVATIVES AS BROMODOMAIN INHIBITORS | GILEAD SCIENCES, INC. (US) | 2015-06-04 | — | — | WO | claimed |