Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | TPMT | P51580 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2937667 | 0.77 | MEN1 (0.58) | CYP3A4CYP1A2ALDH1A1GAAKDM4E | |
| SCHEMBL16510466 | 0.77 | CA12 (0.65) | CYP3A4CYP1A2CYP2C9TSHRCYP2C19 | |
| SCHEMBL13100051 | 0.77 | LMNA (0.52) | CYP3A4CYP1A2CYP2C9TSHRCYP2C19 | |
| SCHEMBL16510467 | 0.76 | TSHR (0.46) | CYP3A4CYP1A2CYP2C9TSHRCYP2C19 | |
| SCHEMBL14708023 | 0.73 | TRPA1 (0.56) | CYP3A4CYP1A2TSHRCYP1B1ALDH1A1 | |
| SCHEMBL10288243 | 0.73 | CYP1A2 (0.44) | CYP3A4CYP1A2CYP2C9TSHRCYP2C19 | |
| SCHEMBL12963319 | 0.72 | TSHR (0.60) | TSHRALDH1A1GAAKDM4EPDE4A | |
| SCHEMBL145388 | 0.71 | MAOB (0.55) | CYP3A4CYP1A2ALDH1A1KMT2AMEN1 | |
| SCHEMBL14074156 | 0.70 | HPGD (0.63) | CYP3A4CYP1A2CYP2C9TSHRCYP2C19 | |
| SCHEMBL23876228 | 0.70 | ALDH1A1 (0.65) | CYP3A4TSHRALDH1A1GAAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1513821-B1 | PROTEIN KINASE INHIBITORS | CYTOPIA PTY LTD (AU) | 2007-10-31 | — | — | EP | disclosed |