Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL638853 | 0.97 | OPRM1 (0.44) | OPRM1SPHK1FDPSSMPD1TSHR | |
| Sulfuric Acid SCHEMBL28958364 | 0.85 | TP53 (0.55) | OPRM1SPHK1FDPSTP53SMPD1 | |
| SCHEMBL28403688 | 0.81 | TSHR (0.35) | OPRM1SPHK1TSHRALDH1A1 | |
| Bromide SCHEMBL28403691 | 0.80 | TSHR (0.34) | OPRM1TSHRALDH1A1 | |
| Water SCHEMBL18549326 | 0.78 | OPRM1 (0.32) | OPRM1 | |
| SCHEMBL18950020 | 0.77 | OPRM1 (0.44) | OPRM1SPHK1FDPSTP53SMPD1 | |
| SCHEMBL1269092 | 0.76 | TSHR (0.44) | FDPSSMPD1TSHRTHRBDNM1 | |
| SCHEMBL19253997 | 0.75 | OPRM1 (0.42) | OPRM1SPHK1FDPSSMPD1TSHR | |
| SCHEMBL11792783 | 0.75 | OPRM1 (0.42) | OPRM1SPHK1FDPSSMPD1TSHR | |
| SCHEMBL15573847 | 0.75 | OPRM1 (0.42) | OPRM1SPHK1FDPSSMPD1TSHR |
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-0087709-A1 | N,N',N\"-triaryl-1,2,3-triaminopropane derivatives, process for their preparation and their use as intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-09-07 | — | — | EP | disclosed |
| EP-0087709-A1 | N,N',N\"-triaryl-1,2,3-triaminopropane derivatives, process for their preparation and their use as intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-09-07 | — | — | EP | disclosed |