Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 9/20 | 0.44 |
| ▸ | HTR1B | P28222 | 5/20 | 0.44 |
| ▸ | HTR2A | P28223 | 5/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL7935768 | 0.79 | HTR1D (0.65) | HTR1DHTR1BHTR2AEPHX2NR1H4 | |
| SCHEMBL8792134 | 0.78 | HTR1D (0.59) | HTR1DHTR1BHTR2AKDM4EMEN1 | |
| SCHEMBL1122381 | 0.66 | ALDH1A1 (0.53) | HTR1DHTR2AALDH1A1MAPTHPGD | |
| SCHEMBL8615090 | 0.65 | HTR6 (0.49) | HTR1DHTR1BHTR2AKDM4EMAPT | |
| SCHEMBL8795470 | 0.64 | HTR1D (0.62) | HTR1DHTR1BHTR2AKDM4EMEN1 | |
| SCHEMBL1122080 | 0.64 | HTR2A (0.53) | HTR1DHTR2AHTR2CHTR6 | |
| SCHEMBL30443765 | 0.63 | HTR2C (0.58) | HTR1DHTR2AHTR2CHTR6 | |
| SCHEMBL5244630 | 0.62 | MAPT (0.53) | HTR1DHTR1BHTR2AKDM4EMEN1 | |
| SCHEMBL1122382 | 0.62 | HTR6 (0.51) | HTR1DHTR2AEPHX2NR1H4HTR2C | |
| Hydrochloric Acid SCHEMBL5249374 | 0.62 | MAPT (0.52) | HTR1DHTR1BHTR2AKDM4EMEN1 |
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-0763034-A1 | AMIDE DERIVATIVES HAVING 5HT1D-ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1997-03-19 | — | — | EP | disclosed |
| WO-1995032967-A1 | AMIDE DERIVATIVES HAVING 5HT1D-ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1995-12-07 | — | — | WO | disclosed |