Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | CASP7 | P55210 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31001160 | 0.75 | ALDH1A1 (0.46) | GPR3ALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL16118411 | 0.71 | GPR3 (0.40) | GPR3IDO1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL2484093 | 0.71 | GPR3 (0.40) | GPR3IDO1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL1423001 | 0.71 | GPR3 (0.46) | GPR3ALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL7217441 | 0.71 | MAOA (0.44) | GPR3ALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL5276597 | 0.71 | GPR3 (0.40) | GPR3IDO1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL1013979 | 0.71 | ALDH1A1 (0.44) | GPR3IDO1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL2494366 | 0.71 | CYP1A2 (0.43) | GPR3ALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL29959532 | 0.71 | GPR3 (0.36) | GPR3IDO1ALDH1A1HPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL6648426 | 0.70 | RAB9A (0.46) | GPR3IDO1ALDH1A1HPGDSMN1; SMN2 |
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-2091916-A2 | L-PHENYLALANINE DERIVATIVES AND THEIR USE AS INTEGRIN ANTAGONISTS | AstraZeneca AB (SE) | 2009-08-26 | — | — | EP | disclosed |
| WO-2007060408-A2 | L-PHENYLALANINE DERIVATIVES AND THEIR USE AS INTEGRIN ANTAGONISTS | ASTRAZENECA AB (SE) | 2007-05-31 | — | — | WO | disclosed |