Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 1/20 | 0.55 |
| ▸ | RPTOR | Q8N122 | 1/20 | 0.55 |
| ▸ | MLST8 | Q9BVC4 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20139222 | 0.85 | MTOR (0.53) | MTORRPTORMLST8KDM4EALDH1A1 | |
| SCHEMBL20139939 | 0.81 | GRM1 (0.67) | GRM1DRD2CHRM4CHRM2CYP3A4 | |
| SCHEMBL20141221 | 0.78 | CHRM2 (0.49) | ALDH1A1GRM1CHRM4CHRM2CHRM5 | |
| SCHEMBL20140156 | 0.77 | CHRM2 (0.57) | ALDH1A1GRM1CHRM4CHRM2CHRM5 | |
| SCHEMBL29955236 | 0.75 | NOTUM (0.59) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL2560204 | 0.75 | NOTUM (0.59) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL29952998 | 0.75 | NOTUM (0.59) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL2557573 | 0.74 | KDM4E (0.67) | MTORRPTORMLST8KDM4EALDH1A1 | |
| SCHEMBL25330081 | 0.73 | GRM1 (0.44) | GRM1CHRM4CHRM2CHRM5CYP3A4 | |
| SCHEMBL20139536 | 0.73 | MTOR (1.00) | MTORRPTORMLST8CHRM4CHRM2 |
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-2018089493-A1 | PYRROLE mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |