Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 5/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290484 | 0.86 | ALOX15 (0.51) | ALOX15CYP2D6CYP3A4TSHRCYP2C9 | |
| Tert-Butyl Formate SCHEMBL28872040 | 0.85 | ALOX15 (0.53) | ALOX15CYP2D6CYP3A4TSHRCYP2C9 | |
| Tert-Butyl Formate SCHEMBL28289070 | 0.77 | CHRM2 (0.38) | ALOX15CYP2D6CYP3A4TSHRCYP2C9 | |
| Tert-Butyl Formate SCHEMBL27921475 | 0.71 | BIRC2 (0.40) | ALOX15CYP1A2MAPK1CYP2C19 | |
| Tert-Butyl Formate SCHEMBL27921474 | 0.71 | BIRC2 (0.40) | ALOX15CYP1A2MAPK1CYP2C19 | |
| Tert-Butyl Formate SCHEMBL28289065 | 0.70 | BIRC2 (0.37) | — | |
| Tert-Butyl Formate SCHEMBL27947060 | 0.70 | BIRC2 (0.49) | — | |
| Tert-Butyl Formate SCHEMBL27947062 | 0.70 | BIRC2 (0.49) | — | |
| Tert-Butyl Formate SCHEMBL27742720 | 0.69 | BIRC2 (0.36) | ALOX15CYP1A2CYP2C19CHRM1 | |
| Tert-Butyl Formate SCHEMBL27742721 | 0.69 | BIRC2 (0.36) | ALOX15CYP1A2CYP2C19CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109563092-A | It can be used as the 2- phenylimidazole of the active inhibitor of mammal tyrosine kinase ROR1 simultaneously [4,5-B] pyridine -7- amine derivative | 坎塞拉有限公司 | 2019-04-02 | — | — | CN | disclosed |