Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PORCN | Q9H237 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29871537 | 0.77 | GAA (0.43) | MAPTKDM4ETP53SMN1; SMN2POLB | |
| SCHEMBL9938286 | 0.76 | ACHE (0.38) | ACHEKDM4ESMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL9938270 | 0.76 | ACHE (0.40) | ACHERAB9A | |
| SCHEMBL9937653 | 0.75 | KMT2A (0.37) | ROCK2MAPTKDM4EPOLBHPGD | |
| SCHEMBL668901 | 0.75 | CA12 (0.41) | MAPTKDM4ETP53SMN1; SMN2POLB | |
| SCHEMBL996026 | 0.75 | CA12 (0.41) | MAPTKDM4ETP53SMN1; SMN2POLB | |
| SCHEMBL669403 | 0.73 | KMT2A (0.55) | MAPTKDM4EPOLBHSD17B10TDP1 | |
| SCHEMBL19253296 | 0.73 | NCEH1 (0.30) | MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL26104675 | 0.73 | MEN1 (0.30) | MAPTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL25278087 | 0.72 | DPP8 (0.34) | ROCK2MAPTSMN1; SMN2TDP1RAB9A |
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 |