Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 14/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7703022 | 0.89 | NPC1 (0.56) | ADORA2ANPC1RAB9ATP53MAPT | |
| SCHEMBL7705941 | 0.85 | ADORA2A (0.51) | ADORA2AALDH1A1 | |
| SCHEMBL7703126 | 0.83 | ADORA2A (0.53) | ADORA2ANPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL7709143 | 0.83 | RXRA (0.44) | ADORA2ANPC1RAB9ATP53MAPT | |
| SCHEMBL7703024 | 0.79 | ADORA2A (0.49) | ADORA2AALDH1A1TDP1 | |
| SCHEMBL7705869 | 0.78 | ADORA2A (0.56) | ADORA2ANPC1RAB9ATP53MAPT | |
| SCHEMBL7487041 | 0.78 | ADORA2A (0.51) | ADORA2ANPC1RAB9ATP53MAPT | |
| SCHEMBL7708821 | 0.76 | ADORA2A (0.54) | ADORA2AMAPTTDP1 | |
| SCHEMBL7711821 | 0.76 | ADORA2A (0.54) | ADORA2AMAPTALDH1A1MEN1KMT2A | |
| SCHEMBL7708427 | 0.75 | ADORA2A (0.53) | ADORA2ANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |