Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 11/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | ADH1B | P00325 | 1/20 | 0.36 |
| ▸ | ADH1C | P00326 | 1/20 | 0.36 |
| ▸ | ADH1A | P07327 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12778343 | 0.79 | CA2 (0.39) | CA2ANPEPADH1BADH1CADH1A | |
| SCHEMBL13588745 | 0.77 | CA2 (0.38) | CA2ANPEPADH1BADH1CADH1A | |
| SCHEMBL9117380 | 0.77 | CA2 (0.38) | CA2ANPEPADH1BADH1CADH1A | |
| SCHEMBL1805896 | 0.77 | CA1 (0.37) | CA2CA12CA7CA9CA14 | |
| SCHEMBL14200545 | 0.76 | CA2 (0.45) | CA2ANPEPADH1BADH1CADH1A | |
| SCHEMBL17033956 | 0.73 | — | — | |
| SCHEMBL6494923 | 0.71 | CA1 (0.31) | CA2CA9 | |
| SCHEMBL1005943 | 0.71 | ADH1B (0.45) | CA2ANPEPADH1BADH1CADH1A | |
| SCHEMBL917453 | 0.70 | CA2 (0.46) | CA2ANPEPADH1BADH1CADH1A | |
| SCHEMBL10962640 | 0.69 | CA12 (0.53) | CA2CA12CA7CA9CA14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019160882-A1 | PD-1/PD-L1 INHIBITORS | GILEAD SCIENCES, INC. (US) | 2019-08-22 | — | — | WO | disclosed |