Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 17/20 | 0.92 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | THPO | P40225 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6597247 | 0.96 | OPRK1 (1.00) | OPRK1OPRD1OPRM1CYP2D6CYP1A2 | |
| SCHEMBL6479102 | 0.96 | OPRK1 (1.00) | OPRK1OPRD1OPRM1CYP2D6CYP1A2 | |
| SCHEMBL6479105 | 0.96 | OPRK1 (1.00) | OPRK1OPRD1OPRM1CYP2D6CYP1A2 | |
| SCHEMBL7692832 | 0.89 | OPRK1 (0.91) | OPRK1OPRD1OPRM1CYP2D6CYP3A4 | |
| Hydrochloric Acid SCHEMBL6479733 | 0.85 | OPRK1 (0.98) | OPRK1OPRD1OPRM1CYP2D6 | |
| Hydrochloric Acid SCHEMBL6479735 | 0.85 | OPRK1 (0.98) | OPRK1OPRD1OPRM1CYP2D6 | |
| SCHEMBL6478689 | 0.84 | OPRK1 (1.00) | OPRK1OPRD1CYP2D6CYP3A4TSHR | |
| SCHEMBL6478692 | 0.84 | OPRK1 (1.00) | OPRK1OPRD1CYP2D6CYP3A4TSHR | |
| SCHEMBL17873664 | 0.83 | OPRK1 (1.00) | OPRK1OPRD1CYP2D6 | |
| SCHEMBL17873667 | 0.83 | OPRK1 (1.00) | OPRK1OPRD1CYP2D6 |
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-6054445-A | KAPPA OPIOID AGONIST ACTIVITY; ANALGESICS AND ANTI-PRURITIC AGENTS | ADOLOR CORPORATION (US) | 2000-04-25 | — | — | US | disclosed |