Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 9/20 | 0.58 |
| ▸ | HTR1B | P28222 | 9/20 | 0.58 |
| ▸ | HTR1F | P30939 | 5/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | THPO | P40225 | 1/20 | 0.53 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 3/20 | 0.47 |
| ▸ | HTR6 | P50406 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7020706 | 0.78 | HTR1D (0.62) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL8789481 | 0.76 | HTR1D (0.59) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL7710792 | 0.75 | HTR1D (0.67) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL8090606 | 0.75 | KDM4E (0.54) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL8784407 | 0.75 | HTR1D (0.60) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL7014030 | 0.74 | HTR1D (0.57) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL7335724 | 0.74 | HTR6 (0.68) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL7011996 | 0.74 | HTR1F (1.00) | HTR1DHTR1BHTR1FHTR1AHTR6 | |
| SCHEMBL27498567 | 0.74 | HTR1D (0.66) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 | |
| SCHEMBL27516181 | 0.74 | HTR1D (0.62) | HTR1DHTR1BHTR1FCYP1A2CYP3A4 |
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-0674620-A1 | TRYPTAMINE ANALOGUES AS 5-HT 1?-LIKE AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-10-04 | — | — | EP | disclosed |
| WO-1994014771-A1 | TRYPTAMINE ANALOGUES AS 5-HT1-LIKE AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-07-07 | — | — | WO | disclosed |