Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 6/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL187606 | 0.82 | TDP1 (0.52) | ALDH1A1CYP1A2CYP2C9PGRADRA2A | |
| SCHEMBL19695429 | 0.82 | TDP1 (0.52) | ALDH1A1CYP1A2CYP2C9PGRADRA2A | |
| SCHEMBL1928398 | 0.79 | SMN1; SMN2 (0.57) | ALDH1A1CYP1A2CYP2C9KDM4ELMNA | |
| SCHEMBL11433567 | 0.75 | PARP10 (0.55) | ALDH1A1CYP1A2SMN1; SMN2MAPTNPC1 | |
| SCHEMBL28878824 | 0.75 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2C9PGRADRA2A | |
| SCHEMBL6512835 | 0.74 | TSHR (0.59) | ALDH1A1CYP2C9SMN1; SMN2L3MBTL1CES2 | |
| SCHEMBL8995222 | 0.74 | L3MBTL1 (0.51) | ALDH1A1CYP1A2CYP2C9KDM4ELMNA | |
| SCHEMBL633160 | 0.72 | ALDH1A1 (0.52) | ALDH1A1CYP1A2CYP2C9ADRA2BLMNA | |
| SCHEMBL20703078 | 0.72 | CES2 (0.52) | ALDH1A1CYP1A2CYP2C9LMNAMAPT | |
| SCHEMBL634337 | 0.72 | CES2 (0.52) | ALDH1A1CYP1A2CYP2C9LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5496844-A | Indole derivatives | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1996-03-05 | — | — | US | disclosed |
| EP-0639567-A1 | INDOLE DERIVATIVE | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1995-02-22 | — | — | EP | disclosed |