Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | PTGER1 | P34995 | 8/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.47 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | RXRB | P28702 | 1/20 | 0.47 |
| ▸ | RXRG | P48443 | 1/20 | 0.47 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.46 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.46 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL26003748 | 0.87 | SMN1; SMN2 (0.50) | BRD4CA12CA1CA2CA9 | |
| SCHEMBL3436590 | 0.83 | CA12 (0.52) | BRD4CA12CA1CA2CA9 | |
| SCHEMBL4688360 | 0.82 | MCL1 (0.56) | MCL1SRD5A2MDM2KMT2A | |
| SCHEMBL31562391 | 0.81 | PTGER1 (0.45) | BRD4CA12CA1CA2CA9 | |
| SCHEMBL17473560 | 0.79 | PKM (0.58) | SRD5A2SRD5A1MDM2KMT2A | |
| SCHEMBL28029738 | 0.78 | PKM (0.62) | BRD4PTGER1KMT2A | |
| SCHEMBL26003749 | 0.78 | PTGER1 (0.51) | BRD4PTGER1MCL1RXRARXRB | |
| SCHEMBL31561132 | 0.76 | PTGER1 (0.42) | PTGER1KMT2A | |
| SCHEMBL26003803 | 0.76 | MET (0.43) | PTGER1KMT2A | |
| SCHEMBL31562441 | 0.76 | PTGER1 (0.43) | BRD4PTGER1TP53 |
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-1685113-A1 | SUBSTITUTED PYRAZOLES AS PPAR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005049578-A1 | SUBSTITUTED PYRAZOLES AS PPAR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-06-02 | — | — | WO | disclosed |