Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 3/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7705845 | 0.90 | ADORA2A (0.49) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7705856 | 0.88 | ADORA2A (0.54) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7703127 | 0.86 | ADORA2A (0.52) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7428533 | 0.85 | ADORA2A (0.60) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7426515 | 0.85 | ADORA2A (0.51) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7708776 | 0.85 | ADORA2A (0.53) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7481320 | 0.83 | ADORA2A (0.54) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7427435 | 0.83 | ADORA2A (0.54) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7708845 | 0.83 | ADORA2A (0.54) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7431418 | 0.83 | ADORA2A (0.56) | ADORA2ANPC1RAB9ASMN1; SMN2MAPT |
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 |