Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | HPN | P05981 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 3/20 | 0.37 |
| ▸ | PPARA | Q07869 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.36 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.36 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.36 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7399637 | 0.83 | CXCR2 (0.41) | KDM4APPARGCYP2C9CYP2C19BCHE | |
| SCHEMBL7400274 | 0.80 | MTNR1A (0.47) | MTNR1AMTNR1BNQO2CYP2C9CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL7401358 | 0.78 | MCL1 (0.40) | MCL1MTNR1AMTNR1BPPARGPPARA | |
| SCHEMBL25946487 | 0.76 | MTNR1A (0.41) | MTNR1AMTNR1BHPNKDM4ANQO2 | |
| SCHEMBL7399530 | 0.76 | MTNR1A (0.40) | MTNR1AMTNR1BNQO2CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL7403768 | 0.76 | CA12 (0.42) | MCL1MTNR1AMTNR1BEDNRBEDNRA | |
| SCHEMBL7316466 | 0.74 | HTR6 (0.41) | MCL1NQO2BRD9BAZ2BBAZ2A | |
| SCHEMBL7392587 | 0.74 | CXCR2 (0.48) | MTNR1AMTNR1BNQO2PPARGCYP2C9 | |
| SCHEMBL24300007 | 0.74 | BRD4 (0.56) | KDM4ANQO2CYP2C9BRD4CREBBP | |
| SCHEMBL7397679 | 0.72 | MTNR1A (0.46) | MTNR1AMTNR1BHPNNQO2PPARG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001034146-A1 | NOVEL ANTI-INFECTIVES | SMITHKLINE BEECHAM CORPORATION (US) | 2001-05-17 | — | — | WO | disclosed |