Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | HPGD | P15428 | 6/20 | 0.37 |
| ▸ | MAOB | P27338 | 5/20 | 0.37 |
| ▸ | GLA | P06280 | 5/20 | 0.37 |
| ▸ | GAA | P10253 | 5/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | KLK7 | P49862 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 7/20 | 0.35 |
| ▸ | RAB9A | P51151 | 7/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18535462 | 0.90 | KDM4E (0.38) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL18535532 | 0.81 | NPC1 (0.38) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL18535468 | 0.77 | RAB9A (0.39) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL18535455 | 0.76 | MAOB (0.34) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL23395649 | 0.73 | HDAC6 (0.38) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL18583497 | 0.73 | STS (0.35) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL21116509 | 0.72 | RXFP1 (0.38) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL18535543 | 0.72 | MAOB (0.40) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL18535514 | 0.71 | KLK7 (0.36) | KDM4EALDH1A1HPGDMAOBGLA | |
| SCHEMBL18535500 | 0.70 | ACHE (0.40) | KDM4EALDH1A1HPGDMAOBGLA |
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-3133065-A1 | COMPOUNDS FOR OPTICALLY ACTIVE DEVICES | Merck Patent GmbH (DE) | 2017-02-22 | — | — | EP | disclosed |