Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 11/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15541454 | 0.93 | KMT2A (0.51) | KMT2AMAPTMEN1TDP1CA9 | |
| SCHEMBL23199773 | 0.85 | HSD17B10 (0.44) | KMT2AMAPTMEN1TDP1POLB | |
| SCHEMBL9937599 | 0.84 | KMT2A (0.53) | KMT2AMAPTMEN1TDP1ALDH1A1 | |
| SCHEMBL9937518 | 0.83 | KMT2A (0.38) | KMT2AMAPTMEN1TDP1POLB | |
| SCHEMBL996026 | 0.83 | CA12 (0.41) | KMT2AMAPTMEN1TDP1CA9 | |
| SCHEMBL668901 | 0.83 | CA12 (0.41) | KMT2AMAPTMEN1TDP1CA9 | |
| SCHEMBL9937557 | 0.82 | MAPT (0.41) | KMT2AMAPTMEN1TDP1POLB | |
| SCHEMBL19253296 | 0.81 | NCEH1 (0.30) | KMT2AMAPTMEN1 | |
| SCHEMBL26104675 | 0.81 | MEN1 (0.30) | KMT2AMAPTMEN1 | |
| SCHEMBL9938274 | 0.80 | ELANE (0.38) | TDP1CA9CA12ALDH1A1HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2651916-A2 | C-17-HETEROARYL STEROIDAL COMPOUNDS AS INHIBITORS OF CYP11B, CYP17, AND/OR CYP21 | BioMarin Pharmaceutical Inc. (US) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012083112-A2 | CYP11B, CYP17, AND/OR CYP21 INHIBITORS | BIOMARIN PHARMACEUTICAL INC. (US) | 2012-06-21 | — | — | WO | disclosed |
| WO-2012022880-A2 | METHOD FOR SYNTHESIZING STEROIDS | UNIVERSITE DE STRASBOURG (FR) | 2012-02-23 | — | — | WO | disclosed |