Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 3/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7305773 | 0.94 | HTR2B (0.54) | HTR2BCHRM2CHRM3SIGMAR1ABCB1 | |
| SCHEMBL7306441 | 0.90 | HTR2B (0.48) | HTR2BCHRM2CHRM3SIGMAR1ABCB1 | |
| SCHEMBL7305604 | 0.88 | HTR2B (0.56) | HTR2BCHRM2CHRM3SIGMAR1ABCB1 | |
| SCHEMBL7307163 | 0.86 | HTR2B (0.50) | HTR2BCHRM2CHRM3SIGMAR1ABCB1 | |
| SCHEMBL7308770 | 0.85 | LTA4H (0.44) | SIGMAR1ABCB1CACNA1GHTR1AADRA2A | |
| SCHEMBL7304924 | 0.85 | HTR2B (0.49) | HTR2BCHRM2CHRM3SIGMAR1ABCB1 | |
| SCHEMBL7309375 | 0.85 | SIGMAR1 (0.45) | HTR2BSIGMAR1ABCB1CACNA1GHTR1A | |
| SCHEMBL7314561 | 0.85 | SIGMAR1 (0.45) | HTR2BSIGMAR1ABCB1CACNA1GHTR1A | |
| SCHEMBL7311873 | 0.85 | HTR7 (0.45) | HTR2BSIGMAR1ABCB1CACNA1GHTR1A | |
| SCHEMBL7303482 | 0.84 | HTR2B (0.48) | HTR2BCCR8 |
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-5776937-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-07-07 | — | — | US | disclosed |
| EP-0711770-A1 | Antagonists of adhesion receptors | MERCK PATENT GmbH (DE) | 1996-05-15 | — | — | EP | disclosed |