Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.56 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | CTSV | O60911 | 6/20 | 0.53 |
| ▸ | CTSL | P07711 | 6/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16712560 | 1.00 | AKR1C3 (0.56) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL4856681 | 0.91 | AKR1C3 (0.51) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL8391099 | 0.88 | AKR1C3 (0.71) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL6665583 | 0.81 | MAOB (0.55) | MEN1MAPTKMT2ACTSVCTSL | |
| SCHEMBL5580003 | 0.79 | CTSV (0.57) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL10628224 | 0.78 | KMT2A (0.55) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL2112961 | 0.78 | AKR1C3 (0.67) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL29532900 | 0.78 | AKR1C3 (0.67) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL10531659 | 0.77 | L3MBTL1 (0.51) | AKR1C3AKR1C2MEN1MAPTKMT2A | |
| SCHEMBL4936955 | 0.76 | CTSV (0.57) | MEN1MAPTKMT2ACTSVCTSL |
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 |
|---|---|---|---|---|---|---|---|
| EP-1606268-B1 | 5,10-DIHYDRO-11H-DIBENZO[B,E][1,4]DIAZEPIN-11-ONE AS KINASE INHIBITORS | ABBVIE INC (US) | 2015-05-20 | — | — | EP | disclosed |