Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | CLPP | Q16740 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL22263126 | 0.91 | HTT (0.41) | MAPK1ALDH1A1HTTSIGMAR1CLPP | |
| SCHEMBL20917965 | 0.90 | MAPK1 (0.41) | MAPK1ALDH1A1OPRL1SIGMAR1L3MBTL1 | |
| SCHEMBL19019905 | 0.90 | ALDH1A1 (0.40) | ALDH1A1HTTGAAPOLBCYP1A2 | |
| SCHEMBL19019925 | 0.89 | TRPV6 (0.43) | ALDH1A1HTTOPRL1SIGMAR1L3MBTL1 | |
| SCHEMBL19061947 | 0.87 | P2RX7 (0.44) | MAPK1ALDH1A1GAARAB9ASMN1; SMN2 | |
| SCHEMBL19061440 | 0.87 | MAPK1 (0.46) | MAPK1ALDH1A1HTTOPRL1SIGMAR1 | |
| SCHEMBL19062037 | 0.87 | METAP2 (0.43) | MAPK1ALDH1A1L3MBTL1TDP1MAPT | |
| SCHEMBL19061438 | 0.84 | ALDH1A1 (0.43) | MAPK1ALDH1A1HTTSIGMAR1L3MBTL1 | |
| SCHEMBL20917786 | 0.81 | ALOX15B (0.46) | MAPK1ALDH1A1SIGMAR1CLPPL3MBTL1 | |
| SCHEMBL20920185 | 0.81 | CYP1A2 (0.42) | MAPK1HTTSIGMAR1L3MBTL1DRD4 |
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-2019078246-A1 | IDO/TDO INHIBITOR | 一般社団法人ファルマバレープロジェクト支援機構 | 2019-04-25 | — | — | WO | disclosed |
| EP-3184514-A1 | AUTOPHAGY INHIBITORS | Deutsches Krebsforschungszentrum (DE) | 2017-06-28 | — | — | EP | disclosed |