Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
| ▸ | TDP2 | O95551 | 1/20 | 0.37 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9418937 | 0.81 | NPC1 (0.55) | MAPTNPC1RAB9AHSD17B1L3MBTL1 | |
| SCHEMBL9418974 | 0.77 | RARB (0.63) | NPC1RAB9AKDM4ERXRARXRB | |
| SCHEMBL9418972 | 0.77 | RARB (0.63) | NPC1RAB9AKDM4ERXRARXRB | |
| SCHEMBL14614757 | 0.73 | CALCRL (0.47) | MAPTNPC1RAB9AHSD17B1PGR | |
| SCHEMBL17926682 | 0.73 | MAPT (0.46) | MAPTNPC1RAB9AHSD17B1L3MBTL1 | |
| SCHEMBL12516220 | 0.72 | MAPT (0.53) | MAPTNPC1RAB9AHSD17B1PGR | |
| SCHEMBL29793289 | 0.71 | NPC1 (0.67) | MAPTNPC1RAB9AHSD17B1HPGD | |
| SCHEMBL21584068 | 0.71 | NPC1 (0.67) | MAPTNPC1RAB9AHSD17B1HPGD | |
| SCHEMBL15202656 | 0.71 | MAPT (0.80) | MAPTNPC1RAB9AHSD17B1L3MBTL1 | |
| SCHEMBL865765 | 0.71 | KMT2A (0.45) | MAPTNPC1RAB9AHSD17B1HPGD |
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-0315071-B1 | Benzocyclohepten derivatives, their preparation and utilisation for pharmaceutics | HOFFMANN LA ROCHE (CH) | 1994-07-20 | — | — | EP | disclosed |
| US-4992574-A | Skin disorders, antiallergens, antiinflammatory agent | HOFFMANN-LA ROCHE INC. (US) | 1991-02-12 | — | — | US | disclosed |