Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 9/20 | 0.53 |
| ▸ | BCHE | P06276 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17981027 | 0.90 | ADORA2A (0.44) | ACHEBCHESMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL17981068 | 0.89 | ACHE (0.43) | ACHEBCHEMKNK1SMN1; SMN2ALDH1A1 | |
| SCHEMBL18024501 | 0.88 | CHKA (0.47) | SMN1; SMN2ALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL18024249 | 0.88 | ACHE (0.46) | ACHEBCHENPC1 | |
| SCHEMBL17981325 | 0.86 | PRKCQ (0.46) | ACHEBCHEALDH1A1 | |
| SCHEMBL19762276 | 0.84 | ACHE (0.48) | ACHEBCHEKDM4EMKNK1HTR7 | |
| SCHEMBL17981234 | 0.84 | MCHR1 (0.48) | POLB | |
| SCHEMBL19762314 | 0.83 | KMT2A (0.39) | ACHEBCHEALDH1A1NPC1ADORA2A | |
| SCHEMBL18024240 | 0.83 | ACHE (0.39) | ACHEBCHEALDH1A1RAB9AADORA2A | |
| SCHEMBL18024351 | 0.83 | ADORA2A (0.41) | ACHEBCHERAB9ANPC1ADORA2A |
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-2016128465-A1 | SUBSTITUTED MONO- AND POLYAZANAPHTHALENE DERIVATIVES AND THEIR USE | BASILEA PHARMACEUTICA AG (CH) | 2016-08-18 | — | — | WO | disclosed |