Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8010759 | 0.99 | MTNR1A (0.43) | MTNR1AMTNR1BHSD17B10KDM4ETSHR | |
| SCHEMBL7587127 | 0.92 | CHRNB4 (0.40) | MTNR1AMTNR1BHSD17B10KDM4ETSHR | |
| SCHEMBL7584182 | 0.92 | ESR1 (0.40) | MTNR1AMTNR1BHSD17B10KDM4ETSHR | |
| SCHEMBL7587120 | 0.92 | CHRNB4 (0.40) | MTNR1AMTNR1BHSD17B10KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL8014796 | 0.91 | CHRNB4 (0.39) | MTNR1AMTNR1BHSD17B10KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL8011601 | 0.91 | ESR1 (0.39) | MTNR1AMTNR1BHSD17B10KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL8014791 | 0.91 | CHRNB4 (0.39) | MTNR1AMTNR1BHSD17B10KDM4ETSHR | |
| SCHEMBL7582908 | 0.89 | CHRM2 (0.41) | HSD17B10KDM4ETSHRADRA2AADRA2B | |
| SCHEMBL7584146 | 0.89 | PBRM1 (0.40) | MTNR1AMTNR1BOPRK1CYP1A2CYP2D6 | |
| SCHEMBL7588665 | 0.89 | ESR1 (0.40) | MIFNTRK1HSD17B1HSD17B2CHRNB4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1243721-C | Substituted amino compounds and their use as substances having analgesic effect | GRUENENTHAL GMBH (DE) | 2006-03-01 | — | — | CN | disclosed |
| EP-0864559-B1 | Substituted amino compounds and their use as analgesic active substances | GRUENENTHAL GMBH (DE) | 2002-06-05 | — | — | EP | disclosed |
| CN-1197059-A | Substituted amino compounds and their use as substances having analgesic effect | GRUENENTHAL GMBH (DE) | 1998-10-28 | — | — | CN | disclosed |
| EP-0864559-A1 | Substituted amino compounds and their use as analgesic active substances | Grünenthal GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |