Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.57 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | USP2 | O75604 | 5/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4331085 | 0.73 | HSD17B10 (0.59) | HSD17B10TSHRUSP2CYP2D6ALDH1A1 | |
| SCHEMBL219618 | 0.73 | HSD17B10 (1.00) | HSD17B10OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL7587764 | 0.73 | HSD17B10 (1.00) | HSD17B10OPRM1OPRD1OPRK1OPRL1 | |
| Ammonia Solution, Strong SCHEMBL1764035 | 0.72 | HSD17B10 (0.97) | HSD17B10OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL20187016 | 0.72 | HSD17B10 (0.57) | HSD17B10TSHRUSP2CYP2D6OPRM1 | |
| SCHEMBL6162697 | 0.72 | HSD17B10 (0.50) | HSD17B10TSHRUSP2CYP2D6ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6160546 | 0.72 | HSD17B10 (0.97) | HSD17B10OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL3067132 | 0.71 | OPRL1 (0.61) | HSD17B10TSHRUSP2CYP2D6OPRM1 | |
| SCHEMBL4321885 | 0.70 | HSD17B10 (0.55) | HSD17B10TSHRUSP2CYP2D6ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3231229 | 0.70 | OPRL1 (0.60) | HSD17B10TSHRUSP2CYP2D6OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1828227-A4 | NEW PEPTIDIC AND PEPTIDOID BRADYKININ B1 RECEPTOR ANTAGONISTS AND USES THEREOF | UNIV SHERBROOKE (CA) | 2009-07-22 | — | — | EP | disclosed |
| EP-1828227-A1 | NEW PEPTIDIC AND PEPTIDOID BRADYKININ B1 RECEPTOR ANTAGONISTS AND USES THEREOF | Université de Sherbrooke (CA) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006017938-A1 | NEW PEPTIDIC AND PEPTIDOID BRADYKININ B1 RECEPTOR ANTAGONISTS AND USES THEREOF | UNIVERSITé DE SHERBROOKE (CA) | 2006-02-23 | — | — | WO | disclosed |