Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | F11 | P03951 | 1/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.45 |
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | CCR8 | P51685 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | SIK2 | Q9H0K1 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL13680558 | 0.80 | GRIA1 (0.59) | TGFBR1CCR1CCR8CYP2A6SIK2 | |
| SCHEMBL13680569 | 0.78 | NPC1 (0.54) | CA12CA9TGFBR1CCR1CCR8 | |
| SCHEMBL4282655 | 0.78 | CA12 (0.47) | CA12CA9F11CYP2A6CA1 | |
| SCHEMBL13680545 | 0.77 | CA12 (0.67) | CA12CA9F11CA1CA3 | |
| SCHEMBL13680690 | 0.76 | CCR1 (0.50) | TGFBR1CCR1CCR8CYP2A6THRB | |
| SCHEMBL15345000 | 0.75 | CA12 (0.59) | CA12CA9F11CCR1CCR8 | |
| SCHEMBL17505162 | 0.75 | CA12 (0.51) | CA12CA9F11CA1CA3 | |
| SCHEMBL13680856 | 0.75 | CA12 (0.38) | CA12CA9F11CA1CA3 | |
| SCHEMBL16573987 | 0.74 | CA12 (0.73) | CA12CA9F11CA1CA3 | |
| Hydrochloric Acid SCHEMBL11122791 | 0.74 | MAPT (0.47) | CA12CA9F11THRBHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |