Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 5/20 | 0.37 |
| ▸ | HTR1B | P28222 | 5/20 | 0.37 |
| ▸ | HTR2A | P28223 | 5/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8793866 | 0.81 | HTR1D (0.37) | HTR1DHTR1BHTR2AKDM4CALDH1A1 | |
| SCHEMBL7448439 | 0.77 | HTR1D (0.54) | HTR1DHTR1BHTR2AALDH1A1MEN1 | |
| SCHEMBL8570855 | 0.72 | HTR1D (0.67) | HTR1DHTR1BHTR2AALDH1A1MEN1 | |
| SCHEMBL7922225 | 0.72 | NR1H4 (0.39) | ALDH1A1MEN1KMT2AMAPTLMNA | |
| Hydrochloric Acid SCHEMBL7913385 | 0.71 | HTR1D (0.38) | HTR1DHTR1BHTR2AALDH1A1MEN1 | |
| SCHEMBL7920436 | 0.69 | MCHR1 (0.43) | HTR1DHTR1BHTR2AALDH1A1MEN1 | |
| SCHEMBL7920441 | 0.69 | MCHR1 (0.45) | HTR1DHTR1BHTR2AALDH1A1MEN1 | |
| SCHEMBL29055279 | 0.69 | HTR1D (0.34) | HTR1DHTR1BHTR2AALDH1A1MEN1 | |
| SCHEMBL29055286 | 0.68 | CNR2 (0.34) | HTR1DHTR1BHTR2AALDH1A1MEN1 | |
| SCHEMBL29055283 | 0.67 | FGFR4 (0.41) | HTR1DHTR1BHTR2AALDH1A1MEN1 |
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 |