Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NPY2R | P49146 | 3/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.51 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.51 |
| ▸ | RET | P07949 | 3/20 | 0.50 |
| ▸ | KDR | P35968 | 2/20 | 0.50 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3182950 | 0.86 | RET (0.63) | RETKDR | |
| SCHEMBL16620022 | 0.85 | CYP2D6 (0.56) | CYP2D6MEN1CYP2C19KMT2ACHRM1 | |
| SCHEMBL16629103 | 0.77 | POLB (0.55) | CYP2D6MEN1CYP2C19KMT2ACHRM1 | |
| SCHEMBL16620032 | 0.77 | EPHX2 (0.57) | EPHX2NR1H4MEN1CYP2C19KMT2A | |
| SCHEMBL22060074 | 0.77 | EPHX2 (0.66) | EPHX2NR1H4MEN1CYP2C19KMT2A | |
| SCHEMBL4933270 | 0.76 | KIT (0.65) | RET | |
| SCHEMBL16587846 | 0.75 | RET (0.68) | RETKDR | |
| SCHEMBL16620122 | 0.75 | EPHX2 (0.57) | EPHX2NR1H4MEN1CYP2C19KMT2A | |
| SCHEMBL25292715 | 0.75 | ABL1 (0.57) | NPY2RTP53POLB | |
| SCHEMBL16620534 | 0.75 | KDM4E (0.48) | EPHX2MEN1CYP2C19KMT2ANPY2R |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015049325-A1 | THERAPEUTIC INHIBITORS OF CDK8 AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2015-04-09 | — | — | WO | disclosed |
| WO-2015049325-A1 | THERAPEUTIC INHIBITORS OF CDK8 AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2015-04-09 | — | — | WO | disclosed |
| US-20150045255-A1 | Endometrial Phase or Endometrial Cancer Biomarkers | WALFISH, PAUL (CA) | 2015-02-12 | — | — | US | disclosed |