Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4688423 | 0.88 | CTSS (0.50) | CTSSCTSKS1PR3CA12CA1 | |
| SCHEMBL4688415 | 0.88 | CTSS (0.50) | CTSSCTSKS1PR3CA12CA1 | |
| SCHEMBL11880230 | 0.85 | L3MBTL1 (0.48) | CTSSCTSKS1PR3CYP1A2CYP2C9 | |
| SCHEMBL3379450 | 0.85 | CTSS (0.48) | CTSSCTSKMAPTCA12CA1 | |
| SCHEMBL3379447 | 0.85 | CTSS (0.48) | CTSSCTSKMAPTCA12CA1 | |
| SCHEMBL11574358 | 0.84 | CTSS (0.47) | CTSSCTSKS1PR3MAPTCA1 | |
| SCHEMBL11574507 | 0.83 | CTSK (0.46) | CTSSCTSKS1PR3FPR2MEN1 | |
| SCHEMBL11573213 | 0.82 | CTSK (0.50) | CTSSCTSKS1PR3FPR2 | |
| SCHEMBL11574050 | 0.82 | CTSS (0.45) | CTSSCTSKCA12CA1CA2 | |
| SCHEMBL11573047 | 0.82 | CTSS (0.48) | CTSSCTSKS1PR3MAPTCYP2C9 |
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-3988451-A | ANTIBACTERIAL | SMITHKLINE CORPORATION (US) | 1976-10-26 | — | — | US | disclosed |
| US-3931160-A | BACTERICIDE | SMITHKLINE CORPORATION (US) | 1976-01-06 | — | — | US | disclosed |