Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | TP53 | P04637 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | CASP1 | P29466 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9818549 | 0.83 | POLB (0.52) | POLBCYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL15209780 | 0.72 | SLC9A1 (0.46) | POLBCYP3A4LMNAKDM4EMAPT | |
| SCHEMBL4753091 | 0.69 | POLB (0.47) | POLB | |
| SCHEMBL544410 | 0.68 | POLB (0.55) | POLBMEN1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL15428731 | 0.68 | POLB (0.55) | POLBALDH1A1KDM4EPKM | |
| SCHEMBL10992734 | 0.68 | POLB (0.55) | POLBALDH1A1KDM4ETP53PKM | |
| SCHEMBL1816971 | 0.68 | POLB (0.55) | POLBLMNAALDH1A1TP53MAPT | |
| SCHEMBL659324 | 0.68 | CYP3A4 (0.57) | POLBCYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL31586389 | 0.68 | CYP3A4 (0.57) | POLBCYP3A4LMNACYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11473793 | 0.67 | POLB (0.53) | POLBALDH1A1KDM4ETP53PKM |
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-3738958-A1 | AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES AS CCR(9) ANTAGONISTS | ChemoCentryx, Inc. (US) | 2020-11-18 | — | — | EP | disclosed |