Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316429 | 0.91 | CHRM2 (0.38) | CHRM2CHRM1TP53STSRECQL | |
| SCHEMBL7311851 | 0.90 | STS (0.38) | CHRM2CHRM1TP53GPR119STS | |
| SCHEMBL7309076 | 0.85 | ALDH1A1 (0.39) | CHRM2CHRM1TP53STSRECQL | |
| SCHEMBL7305450 | 0.85 | CCR5 (0.35) | CCR5TP53PKMALDH1A1MAPK1 | |
| SCHEMBL7314878 | 0.83 | GLA (0.33) | CCR5 | |
| SCHEMBL25752708 | 0.81 | HPGD (0.44) | CHRM1TP53GPR119RECQLKDM4E | |
| SCHEMBL7310999 | 0.81 | CCR5 (0.35) | CCR5MAPTLMNA | |
| SCHEMBL7303493 | 0.79 | SMN1; SMN2 (0.38) | CHRM2CCR5PKMLMNAALDH1A1 | |
| SCHEMBL7305780 | 0.78 | SMN1; SMN2 (0.43) | RECQLKDM4EFAAHALDH1A1 | |
| SCHEMBL7314434 | 0.76 | CYP1A2 (0.35) | CCR5MAPTLMNAMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0711770-A1 | Antagonists of adhesion receptors | MERCK PATENT GmbH (DE) | 1996-05-15 | — | — | EP | disclosed |