Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 3/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.35 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.35 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.35 |
| ▸ | CLK1 | P49759 | 2/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | CLK3 | P49761 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9371950 | 0.87 | KDR (0.38) | KDRCYP2A6KEAP1VCPFGFR1 | |
| SCHEMBL9371975 | 0.82 | CYP3A4 (0.41) | CYP2A6KEAP1VCPKDM4ECYP3A4 | |
| SCHEMBL9370838 | 0.81 | VCP (0.42) | CYP2A6KEAP1VCPDYRK1ADYRK1B | |
| Hydrochloric Acid SCHEMBL7112841 | 0.79 | VCP (0.41) | CYP2A6KEAP1VCPKDM4ELMNA | |
| SCHEMBL9544511 | 0.77 | MAPT (0.42) | TRPV1KDM4ELMNACYP1A2CYP3A4 | |
| SCHEMBL9370928 | 0.74 | VCP (0.39) | KDRCYP2A6KEAP1VCPFGFR1 | |
| SCHEMBL2359679 | 0.70 | KDM4E (0.47) | TRPV1KDM4ELMNACYP1A2CYP3A4 | |
| SCHEMBL9370533 | 0.69 | CYP2A6 (0.38) | CYP2A6KEAP1VCPKDM4EMAOA | |
| SCHEMBL9370953 | 0.69 | CYP2A6 (0.38) | CYP2A6KEAP1VCPKDM4EMAOA | |
| SCHEMBL28304454 | 0.67 | KDM4E (0.46) | TRPV1KDM4ELMNACYP1A2CYP3A4 |
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-0630373-A1 | INDOLE DERIVATIVES AS 5HT1C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-12-28 | — | — | EP | disclosed |