Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | TPMT | P51580 | 2/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.39 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.39 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.39 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.39 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.39 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | TYK2 | P29597 | 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 | |
|---|---|---|---|---|
| SCHEMBL543454 | 0.83 | TTR (0.65) | TTRTSHRCA5ATPMTDPP4 | |
| Hydrochloric Acid SCHEMBL941982 | 0.81 | TTR (0.62) | TTRTSHRCA5ATPMTDPP4 | |
| Hydrochloric Acid SCHEMBL5512605 | 0.81 | TTR (0.62) | TTRTSHRCA5ATPMTDPP4 | |
| SCHEMBL27383711 | 0.80 | CA5A (0.43) | TTRTSHRCA5AALDH1A1SMN1; SMN2 | |
| SCHEMBL7779178 | 0.78 | CA5A (0.50) | TTRTSHRCA5ATPMTALDH1A1 | |
| SCHEMBL146844 | 0.77 | TTR (0.46) | TTRTSHRTPMTDPP4ALDH1A1 | |
| SCHEMBL10130179 | 0.77 | ALDH1A1 (0.45) | TSHRCA5AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL2964558 | 0.77 | KDM4E (0.50) | TTRTSHRTPMTALDH1A1SMN1; SMN2 | |
| SCHEMBL14060151 | 0.77 | ALDH1A1 (0.53) | TTRTSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL1707624 | 0.77 | TTR (0.42) | TTRTSHRTPMTDPP4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021222789-A1 | INHIBITORS OF ALPHA 2 BETA 1 INTEGRIN AND METHODS OF USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-11-04 | — | — | WO | disclosed |