Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL11248148 | 0.93 | CYP1A2 (0.59) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL11099589 | 0.82 | CYP1A2 (0.61) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL3669020 | 0.79 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL20166866 | 0.79 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL10601728 | 0.74 | CYP1A2 (0.57) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL11253369 | 0.73 | CYP1A2 (0.44) | CYP1A2CYP3A4CYP2C19TP53GAA | |
| SCHEMBL11099581 | 0.71 | CYP1A2 (0.65) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL9713168 | 0.70 | CYP1A2 (0.64) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL27605122 | 0.70 | CYP1A2 (0.54) | CYP1A2CYP3A4CYP2C19TSHRTP53 | |
| SCHEMBL9713323 | 0.70 | CYP1A2 (0.54) | CYP1A2CYP3A4CYP2C19TSHRTP53 |
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-0049071-A1 | N-arylbenzamide derivatives | ELI LILLY AND COMPANY (US) | 1982-04-07 | — | — | EP | disclosed |