Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 4/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL11604012 | 0.86 | OPRM1 (0.47) | ABCB1DRD3ALDH1A1KDM4EOPRM1 | |
| SCHEMBL11465399 | 0.82 | DRD3 (0.44) | DRD3ALDH1A1KDM4EOPRM1OPRD1 | |
| SCHEMBL11454600 | 0.77 | USP2 (0.47) | ALDH1A1KDM4E | |
| SCHEMBL11465183 | 0.77 | OPRD1 (0.43) | ABCB1DRD3ALDH1A1OPRM1OPRD1 | |
| SCHEMBL11455144 | 0.77 | OPRD1 (0.43) | ABCB1DRD3OPRM1OPRD1OPRK1 | |
| SCHEMBL11446599 | 0.76 | ADRA1D (0.51) | ALDH1A1KDM4E | |
| SCHEMBL11465170 | 0.76 | MEN1 (0.51) | ABCB1ALDH1A1KDM4ECYP2D6 | |
| SCHEMBL11604589 | 0.76 | KDM4E (0.43) | ALDH1A1KDM4EOPRD1 | |
| SCHEMBL11447955 | 0.76 | OPRM1 (0.44) | DRD3OPRM1OPRD1OPRK1DRD2 | |
| Hydrochloric Acid SCHEMBL11457400 | 0.76 | ADRA1D (0.53) | ALDH1A1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4205173-A | 1-Heterocyclic alkyl-1,2,3,4-tetrahydroquinazolinones and analgesic intermediates thereof | PENNWALT CORPORATION (US) | 1980-05-27 | — | — | US | disclosed |
| US-4085107-A | ANALGESICS | PENNWALT CORPORATION (US) | 1978-04-18 | — | — | US | disclosed |
| US-4060526-A | 1-Heterocyclic alkyl-1,2,3,4-tetrahydroquinazolinones and analgesic intermediates thereof | PENNWALT CORPORATION (US) | 1977-11-29 | — | — | US | disclosed |