Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.76 |
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.67 |
| ▸ | CASP3 | P42574 | 1/20 | 0.67 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.67 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.67 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.60 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL5696414 | 0.90 | HCAR2 (0.73) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL6032429 | 0.87 | HCAR2 (0.81) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL18510324 | 0.86 | NPC1 (0.80) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL8689332 | 0.86 | HCAR2 (1.00) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL8943790 | 0.86 | HCAR2 (0.79) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL5696427 | 0.85 | HCAR2 (0.78) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL4914608 | 0.84 | HCAR2 (0.76) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL4912964 | 0.84 | NPC1 (0.80) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL4915695 | 0.84 | HCAR2 (0.76) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 | |
| SCHEMBL4650500 | 0.83 | HCAR2 (0.57) | HCAR2TSHRMAPK10ALDH1A1HSD17B10 |
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-1670749-A1 | 2-SUBSTITUTED BENZOIC ACID DERIVATIVES AS HM74A RECEPTOR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-06-21 | — | — | EP | disclosed |
| WO-2005016870-A1 | 2-SUBSTITUTED BENZOIC ACID DERIVATIVES AS HM74A RECEPTOR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |