Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.44 |
| ▸ | THRA | P10827 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.40 |
| ▸ | EYA3 | Q99504 | 2/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8183283 | 0.82 | CA2 (0.54) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL17974165 | 0.80 | CA2 (0.53) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL24770627 | 0.80 | CA2 (0.57) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL15241836 | 0.80 | CA2 (0.53) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL24958682 | 0.78 | CA2 (0.51) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL1253476 | 0.77 | CA2 (0.62) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL15046894 | 0.77 | KDM4E (0.50) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL20562108 | 0.77 | CA2 (0.54) | CA2NR1I3THRATHRBCYP2C19 | |
| Hydrochloric Acid SCHEMBL21964032 | 0.76 | CA2 (0.60) | CA2NR1I3THRATHRBCYP2C19 | |
| SCHEMBL10366055 | 0.74 | THRA (0.53) | CA2NR1I3THRATHRBCYP2C19 |
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-2008104756-A1 | UREA DERIVATIVES AND THEIR THERAPEUTIC USE | SERENTIS LIMITED (GB) | 2008-09-04 | — | — | WO | disclosed |