Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | HTR2C | P28335 | 5/20 | 0.45 |
| ▸ | HTR2B | P41595 | 4/20 | 0.45 |
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14862332 | 0.83 | MAOB (0.47) | HTR2CHTR2BHTR2AHRH3MAOB | |
| SCHEMBL31345963 | 0.78 | TEAD1 (0.42) | HTR1AHTR2CHTR2BFFAR1CHRM2 | |
| SCHEMBL31346002 | 0.78 | TEAD1 (0.42) | HTR1AHTR2CHTR2BFFAR1CHRM2 | |
| SCHEMBL403523 | 0.77 | MAOB (0.65) | MAOBKDM4EADORA3ARCYP19A1 | |
| SCHEMBL32498549 | 0.77 | MAOB (0.65) | MAOBKDM4EADORA3ARCYP19A1 | |
| SCHEMBL14862016 | 0.77 | MAOB (0.52) | MAOBKDM4EADORA3ARCYP19A1 | |
| SCHEMBL28847774 | 0.76 | LMNA (0.48) | HTR1AHTR2CHTR2BHTR2AFFAR1 | |
| Water SCHEMBL6439945 | 0.76 | MAOB (0.62) | MAOBKDM4EADORA3ARCYP19A1 | |
| SCHEMBL31346021 | 0.75 | CYP19A1 (0.42) | HTR1AHTR2CFFAR1DRD3TEAD1 | |
| SCHEMBL31345995 | 0.75 | CYP19A1 (0.45) | HTR1AHTR2CFFAR1DRD3TEAD1 |
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-107266413-A | Heterocycle and phenylpropionic acid derivative and its preparation method and application | 上海大学 | 2017-10-20 | — | — | CN | disclosed |