Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | REN | P00797 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.35 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10068802 | 0.89 | KLKB1 (0.41) | MEN1LMNAKMT2AALDH1A1REN | |
| SCHEMBL10068953 | 0.84 | KLKB1 (0.40) | MEN1LMNAKMT2AALDH1A1REN | |
| SCHEMBL10068784 | 0.81 | MEN1 (0.39) | MEN1LMNAKMT2AALDH1A1REN | |
| SCHEMBL10069048 | 0.81 | MRGPRX4 (0.44) | AURKARPS6KB1MRGPRX4MEN1LMNA | |
| SCHEMBL10068771 | 0.81 | FAAH (0.43) | MEN1LMNAKMT2AALDH1A1MAPK1 | |
| SCHEMBL10068722 | 0.80 | HTT (0.40) | MEN1LMNAKMT2ARENBRD4 | |
| SCHEMBL10069049 | 0.80 | MRGPRX4 (0.40) | AURKARPS6KB1MRGPRX4MEN1LMNA | |
| SCHEMBL10069369 | 0.79 | KDM4E (0.44) | MEN1LMNAKMT2AALDH1A1REN | |
| SCHEMBL10068545 | 0.79 | ADRB2 (0.37) | MRGPRX4MEN1LMNAKMT2AREN | |
| SCHEMBL3341708 | 0.79 | ADRB2 (0.41) | MRGPRX4MEN1LMNAKMT2AREN |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012019428-A1 | BENZOHYDROL DERIVATIVES, A PREPARATION PROCESS AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-02-16 | — | — | WO | disclosed |