Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.40 |
| ▸ | MRGPRX2 | Q96LB1 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8896167 | 0.79 | GPR119 (0.43) | ALDH1A1SMN1; SMN2TSHRHPGDKMT2A | |
| SCHEMBL14713246 | 0.76 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2HIF1AKCNH2OPRM1 | |
| SCHEMBL11608826 | 0.75 | SMN1; SMN2 (0.44) | ALDH1A1SMN1; SMN2HIF1AKCNH2OPRM1 | |
| SCHEMBL8895955 | 0.73 | CTSS (0.47) | SMN1; SMN2KMT2AMEN1CTSS | |
| SCHEMBL8895906 | 0.73 | MMP8 (0.49) | ALDH1A1KMT2AMAPTMEN1 | |
| SCHEMBL8896833 | 0.73 | TSHR (0.48) | ALDH1A1SMN1; SMN2TSHRHPGDKMT2A | |
| SCHEMBL6158106 | 0.73 | SMN1; SMN2 (0.48) | ALDH1A1SMN1; SMN2HIF1APPARGPPARA | |
| SCHEMBL8462886 | 0.73 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2HIF1APPARGPPARA | |
| SCHEMBL21253227 | 0.72 | TRPA1 (0.45) | ALDH1A1SMN1; SMN2HIF1AOPRM1OPRD1 | |
| SCHEMBL21835005 | 0.72 | TRPA1 (0.45) | ALDH1A1SMN1; SMN2HIF1AOPRM1OPRD1 |
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-5656604-A | HYPOTENSIVE AGENT; ENDOTHELIN ANTAGONIST | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-08-12 | — | — | US | disclosed |