Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | AR | P10275 | 9/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.37 |
| ▸ | FNTB | P49356 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL8323517 | 1.00 | KCNJ1 (0.46) | KCNJ1KCNH2NPC1MAPTPKM | |
| SCHEMBL8327952 | 0.90 | CRHBP (0.47) | CYP19A1ARCRHBPCRHR2PYCR1 | |
| SCHEMBL8328066 | 0.87 | CYP19A1 (0.44) | CYP19A1ARCRHBPCRHR2POLB | |
| SCHEMBL8323939 | 0.84 | AR (0.49) | KCNJ1KCNH2NPC1CYP19A1AR | |
| SCHEMBL8327623 | 0.84 | ALDH1A1 (0.50) | NPC1MAPTCYP19A1ARCRHBP | |
| SCHEMBL8326188 | 0.84 | CYP19A1 (0.55) | NPC1MAPTCYP19A1ARCRHBP | |
| SCHEMBL8327171 | 0.84 | CRHBP (0.42) | MAPTCYP19A1ARCRHBPCRHR2 | |
| SCHEMBL8323116 | 0.82 | CYP19A1 (0.39) | MAPTCYP19A1POLB | |
| SCHEMBL8328528 | 0.82 | MEN1 (0.49) | KCNJ1KCNH2NPC1MAPTPKM | |
| SCHEMBL8329428 | 0.81 | MAOA (0.42) | CYP19A1CRHBPCRHR2POLB |
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-0640595-B1 | SUBSTITUTED TERTIARY AMINO COMPOUND OR SALT THEREOF | YAMANOUCHI PHARMA CO LTD (JP) | 1999-03-24 | — | — | EP | disclosed |
| US-5538976-A | ANTICARCINOGENIC AGENTS AND ENZYME INHIBITORS FOR AROMATASE | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1996-07-23 | — | — | US | disclosed |
| EP-0640595-A1 | NOVEL SUBSTITUTED TERTIARY AMINO COMPOUND OR SALT THEREOF | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1995-03-01 | — | — | EP | disclosed |