Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6529660 | 0.77 | KMT2A (0.39) | IDO1TAAR1ALDH1A1HSD17B10TSHR | |
| SCHEMBL11217938 | 0.74 | KDM4E (0.39) | ALDH1A1GAAMAPTTSHRSMN1; SMN2 | |
| SCHEMBL11049042 | 0.74 | HTR2C (0.46) | IDO1TAAR1SIGMAR1CHRM2CHRM1 | |
| SCHEMBL225124 | 0.73 | TAAR1 (0.49) | IDO1TAAR1SIGMAR1KCNH2HRH3 | |
| SCHEMBL6530140 | 0.73 | ALDH1A1 (0.46) | IDO1TAAR1SIGMAR1ALDH1A1MAPT | |
| SCHEMBL1196870 | 0.73 | MAOB (0.40) | TAAR1HSD17B10TSHRHRH3 | |
| SCHEMBL6528481 | 0.71 | HTR1B (0.43) | IDO1TAAR1SIGMAR1CHRM2CHRM1 | |
| SCHEMBL11210840 | 0.71 | CYP1A1 (0.45) | GAAMAPTSMN1; SMN2KDM4E | |
| SCHEMBL27844473 | 0.71 | IDO1 (0.48) | IDO1TAAR1SIGMAR1CHRM2CHRM1 | |
| SCHEMBL8412532 | 0.71 | NFE2L2 (0.49) | IDO1TAAR1SIGMAR1CHRM2CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |