Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 4/20 | 0.45 |
| ▸ | HTR1D | P28221 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | GPR3 | P46089 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.34 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL5748317 | 0.89 | HRH1 (0.49) | HTR1BHTR1DSLC6A4HRH1GPR3 | |
| SCHEMBL5745721 | 0.82 | HTR1B (0.47) | HTR1BGPR3CYP1A2CYP2C19ALKBH5 | |
| SCHEMBL5745923 | 0.81 | HTR1B (0.49) | HTR1BHTR1DGPR3CYP1A2CYP2C19 | |
| SCHEMBL28824473 | 0.79 | GPR3 (0.43) | GPR3CYP1A2CYP2C19ATMALKBH5 | |
| SCHEMBL5776857 | 0.76 | HTR1B (0.45) | HTR1BGPR3ALKBH5FTOKDM4E | |
| SCHEMBL5747600 | 0.75 | HTR1B (0.47) | HTR1BKDM4EKMT2A | |
| SCHEMBL5746059 | 0.74 | HTR1B (0.45) | HTR1BSLC6A4HRH1GPR3HTR6 | |
| SCHEMBL27772278 | 0.74 | LMNA (0.50) | GPR3CYP1A2CYP2C19ATMKDM4E | |
| SCHEMBL5746680 | 0.72 | HTR1B (0.44) | HTR1BGPR3CYP1A2CYP2C19KDM4E | |
| SCHEMBL9908935 | 0.71 | POLB (0.47) | KDM4EALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1711463-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005077899-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2005-08-25 | — | — | WO | disclosed |