Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7444529 | 0.75 | GFER (0.50) | MAPK1MAPTHSD17B10ALOX15CASP1 | |
| SCHEMBL7319481 | 0.72 | KMT2A (0.36) | TSHRMAPK1HTTTP53MAPT | |
| SCHEMBL11283989 | 0.71 | MAOA (0.42) | TSHRMAPK1HTTMAOAMAOB | |
| SCHEMBL10966476 | 0.71 | MAOA (0.39) | TSHRMAPK1HTTMAOAMAOB | |
| SCHEMBL11731471 | 0.70 | AKR1C4 (0.44) | TSHRTP53AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL30888510 | 0.70 | AKR1C4 (0.44) | TSHRTP53AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL11742170 | 0.69 | GFER (0.61) | MAPK1TP53MAPTAKR1C4AKR1C3 | |
| SCHEMBL7332075 | 0.68 | TTR (0.49) | TSHRHTTMAOBMAPTHPGD | |
| SCHEMBL27185574 | 0.65 | CYP3A4 (0.41) | TP53AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL27185572 | 0.65 | CYP3A4 (0.41) | TP53AKR1C4AKR1C3AKR1C2AKR1C1 |
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-0664806-A1 | HETEROCYCLIC CONDENSED BENZOIC ACID DERIVATIVES AS 5-HT 4? RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-08-02 | — | — | EP | disclosed |
| WO-1994008995-A1 | HETEROCYCLIC CONDENSED BENZOIC ACID DERIVATIVES AS 5-HT4 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-04-28 | — | — | WO | disclosed |