Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 2/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 6/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | METAP2 | P50579 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.54 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL1193435 | 0.84 | BCAT2 (0.72) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL19259498 | 0.84 | BCAT2 (0.72) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL27819009 | 0.82 | BCAT2 (0.70) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL1072315 | 0.81 | ALDH1A1 (0.73) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL8971238 | 0.81 | ALDH1A1 (0.73) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL437231 | 0.80 | ALDH1A1 (0.87) | BCAT2ALDH1A1ADRB2CYP3A4MEN1 | |
| SCHEMBL5595491 | 0.79 | ALDH1A1 (0.71) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL27510518 | 0.79 | ALDH1A1 (0.67) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL1441429 | 0.79 | BCAT2 (0.60) | BCAT2ALDH1A1ADRB2CYP3A4CYP1A2 | |
| SCHEMBL11266259 | 0.78 | ALDH1A1 (0.83) | BCAT2ALDH1A1ADRB2CYP3A4MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3325462-A1 | LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF | Pharmakea, Inc. (US) | 2018-05-30 | — | — | EP | disclosed |
| WO-2017015221-A1 | LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF | PHARMAKEA, INC. (US) | 2017-01-26 | — | — | WO | disclosed |