Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 7/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7708420 | 0.88 | ADORA2A (0.51) | ADORA2AKDM4EALDH1A1ADORA3ADORA1 | |
| SCHEMBL7709161 | 0.86 | ADORA2A (0.53) | ADORA2AHSD17B10KDM4EALDH1A1HPGD | |
| SCHEMBL7709024 | 0.84 | NPC1 (0.41) | ADORA2ATSHRHSD17B10KDM4EALDH1A1 | |
| SCHEMBL7709129 | 0.84 | ADORA2A (0.56) | ADORA2A | |
| SCHEMBL7487041 | 0.83 | ADORA2A (0.51) | ADORA2AKDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL7492811 | 0.82 | ADORA2A (0.52) | ADORA2ATSHRHSD17B10KDM4EALDH1A1 | |
| SCHEMBL7711726 | 0.78 | ADORA2A (0.54) | ADORA2AALDH1A1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL7703002 | 0.78 | ADORA2A (0.47) | ADORA2ATSHRHSD17B10KDM4EALDH1A1 | |
| SCHEMBL7711750 | 0.77 | ADORA2A (0.57) | ADORA2AKDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL7711685 | 0.77 | ADORA2A (0.57) | ADORA2AHSD17B10KDM4EALDH1A1HPGD |
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 |