Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | ARG2 | P78540 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1073587 | 0.79 | CES1 (0.46) | CES1CES2AKR1B1MAOBMEN1 | |
| SCHEMBL3485127 | 0.77 | CES1 (0.50) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL19849688 | 0.74 | CTBP2 (0.42) | CES1CES2AKR1B1MAOBMEN1 | |
| SCHEMBL13017383 | 0.73 | CES1 (0.56) | CES1CES2AKR1B1MAOBMEN1 | |
| SCHEMBL11058375 | 0.72 | CES1 (0.40) | CES1CES2AKR1B1MAOBMEN1 | |
| SCHEMBL822099 | 0.72 | CES1 (0.55) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL2241627 | 0.72 | CES1 (0.55) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL12095508 | 0.72 | CES1 (0.55) | CES1CES2AKR1B1MAOBMEN1 | |
| SCHEMBL1333665 | 0.70 | CES1 (0.52) | CES1CES2AKR1B1MEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL574785 | 0.70 | CES1 (0.52) | CES1CES2AKR1B1MEN1KMT2A |
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-2258366-A2 | Quinoline derivatives and quinazoline derivatives capable of inhibiting autophosphorylation of hepatocyte growth factor receptors, and pharmaceutical composition comprising the same | Kirin Pharma Kabushiki Kaisha (JP) | 2010-12-08 | — | — | EP | disclosed |