Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | MAX | P61244 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NSD2 | O96028 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29602086 | 0.85 | PDE2A (0.34) | DYRK1AKDM4EKMT2A | |
| SCHEMBL16226030 | 0.79 | TRPM4 (0.41) | TRPM4CA12CA1CA9IDO1 | |
| SCHEMBL30541938 | 0.75 | HPRT1 (0.52) | LMNATHRBMAPTMEN1KMT2A | |
| SCHEMBL159626 | 0.75 | HPRT1 (0.52) | LMNATHRBMAPTMEN1KMT2A | |
| SCHEMBL30446008 | 0.75 | HPRT1 (0.52) | LMNATHRBMAPTMEN1KMT2A | |
| SCHEMBL12475251 | 0.75 | HPRT1 (0.52) | LMNATHRBMAPTMEN1KMT2A | |
| SCHEMBL31497107 | 0.75 | HPRT1 (0.52) | LMNATHRBMAPTMEN1KMT2A | |
| SCHEMBL16114571 | 0.75 | KDM4E (0.31) | THRBMAPTKDM4EMEN1POLB | |
| Charcoal, Activated SCHEMBL3299280 | 0.74 | HPRT1 (0.50) | LMNAMAPTMEN1KMT2A | |
| SCHEMBL15540285 | 0.73 | HTT (0.47) | LMNAHTTTHRBMAPTKDM4E |
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-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 |