Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK7 | P49862 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | STS | P08842 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4376617 | 1.00 | KLK7 (0.42) | KLK7GAATHRBSMN1; SMN2LMNA | |
| SCHEMBL4376621 | 1.00 | KLK7 (0.42) | KLK7GAATHRBSMN1; SMN2LMNA | |
| SCHEMBL8908032 | 0.83 | KLK7 (0.47) | KLK7GAATHRBSMN1; SMN2LMNA | |
| SCHEMBL8907403 | 0.83 | KLK7 (0.47) | KLK7GAATHRBSMN1; SMN2LMNA | |
| SCHEMBL12299746 | 0.80 | ABCB1 (0.46) | KLK7SMN1; SMN2LMNAKEAP1NFE2L2 | |
| SCHEMBL2938093 | 0.79 | ACHE (0.44) | GAATHRBSMN1; SMN2LMNASTS | |
| SCHEMBL2938095 | 0.79 | ACHE (0.44) | GAATHRBSMN1; SMN2LMNASTS | |
| SCHEMBL17686007 | 0.79 | STS (0.47) | LMNASTSACHEKDM4EPKM | |
| SCHEMBL24411299 | 0.78 | ALDH1A1 (0.37) | SMN1; SMN2MEN1ALDH1A1TSHRKMT2A | |
| SCHEMBL375444 | 0.78 | ALDH1A1 (0.37) | SMN1; SMN2MEN1ALDH1A1TSHRKMT2A |
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-1722793-A1 | BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION | Brystol-Myers Squibb Company (US) | 2006-11-22 | — | — | EP | disclosed |
| WO-2005087232-A1 | BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-09-22 | — | — | WO | disclosed |