Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7452644 | 1.00 | TAAR1 (0.53) | TAAR1RAB9ACTSKEPHX2LMNA | |
| SCHEMBL7452648 | 1.00 | TAAR1 (0.53) | TAAR1RAB9ACTSKEPHX2LMNA | |
| SCHEMBL23235646 | 0.89 | GRM2 (0.44) | TAAR1 | |
| SCHEMBL7223358 | 0.85 | HSD17B10 (0.56) | TAAR1MAPTKDM4EMEN1ALDH1A1 | |
| SCHEMBL5002695 | 0.85 | HSD17B10 (0.56) | TAAR1MAPTKDM4EMEN1ALDH1A1 | |
| SCHEMBL7225398 | 0.83 | NAPRT (0.47) | TAAR1POLBKDM4EALDH1A1 | |
| SCHEMBL7454096 | 0.83 | NAPRT (0.47) | TAAR1POLBKDM4EALDH1A1 | |
| SCHEMBL7454090 | 0.83 | NAPRT (0.47) | TAAR1POLBKDM4EALDH1A1 | |
| SCHEMBL3165178 | 0.80 | GRM2 (0.50) | CTSKLMNAPOLBMEN1ALDH1A1 | |
| SCHEMBL19224560 | 0.79 | CA1 (0.55) | — |
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-6545160-B2 | Alpha-aminoacetic acid derivatives bind alpha 4 beta 7 integrin, useful for treatment of inflammatory diseases in mammalian patient, such as asthma, Alzheimer's disease, atherosclerosis, AIDS dementia, diabetes, rheumatoid arthritis | ELAN PHARMACEUTICALS, INC. | 2003-04-08 | — | — | US | disclosed |