Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 7/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | METAP2 | P50579 | 2/20 | 0.45 |
| ▸ | NOS1 | P29475 | 3/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.45 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL25344307 | 0.88 | METAP2 (0.57) | MEN1KMT2APOLBTRPA1METAP2 | |
| SCHEMBL10598655 | 0.79 | TRPA1 (0.57) | MEN1KMT2ATRPA1TRPM8METAP2 | |
| SCHEMBL3537344 | 0.79 | RAB9A (0.60) | MEN1KMT2ATRPA1MAOBMETAP2 | |
| SCHEMBL25921681 | 0.76 | MAOB (0.47) | MEN1KMT2APOLBMAOBMETAP2 | |
| SCHEMBL5410655 | 0.76 | ROCK2 (0.50) | MEN1KMT2AMAOBMETAP2NOS1 | |
| SCHEMBL14863544 | 0.76 | NOS1 (0.50) | MEN1KMT2APOLBMAOBMETAP2 | |
| SCHEMBL5804533 | 0.76 | MAOB (0.47) | MEN1KMT2AMAOBMETAP2NOS1 | |
| SCHEMBL16023545 | 0.76 | NOS1 (0.50) | MEN1KMT2APOLBTRPA1MAOB | |
| SCHEMBL4980408 | 0.75 | MAOB (0.52) | MEN1KMT2AMAOBMETAP2NOS1 | |
| SCHEMBL5407397 | 0.75 | KCNH2 (0.49) | MEN1KMT2ATRPA1MAOBMETAP2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105451737-B | Medical composition and its use and described pharmaceutical composition are used for the application process practised contraception on demand | 拜耳医药股份有限公司 | 2018-04-10 | — | — | CN | disclosed |
| CN-104144922-B | 2H-indazoles as EP 2 receptor antagonists | 拜耳知识产权有限责任公司 | 2016-08-31 | — | — | CN | disclosed |
| CN-105451737-A | Pharmaceutical composition and the use thereof, and application regime of said pharmaceutical composition for on-demand contraception | Bayer Pharma AG | 2016-03-30 | — | — | CN | disclosed |
| CN-104144922-A | As EP2Novel 2H-indazoles as receptor antagonists | BAYER IP GMBH | 2014-11-12 | — | — | CN | disclosed |