Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.55 |
| ▸ | MTNR1A | P48039 | 15/20 | 0.50 |
| ▸ | NQO2 | P16083 | 14/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 14/20 | 0.50 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | HTR5A | P47898 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7953980 | 0.88 | MTNR1A (0.65) | MTNR1ANQO2MTNR1BADRB2HTR1A | |
| SCHEMBL7945323 | 0.88 | MTNR1A (0.53) | MTNR1ANQO2MTNR1BADRB2HTR1A | |
| SCHEMBL7950125 | 0.84 | MTNR1A (0.67) | TRPV1MTNR1ANQO2MTNR1BADRB2 | |
| Hydrochloric Acid SCHEMBL7943780 | 0.76 | SIGMAR1 (0.61) | MTNR1ANQO2MTNR1BADRB2HTR1A | |
| SCHEMBL7951166 | 0.74 | MTNR1A (0.71) | TRPV1MTNR1ANQO2MTNR1B | |
| SCHEMBL7943657 | 0.73 | MTNR1A (0.64) | MTNR1ANQO2MTNR1B | |
| SCHEMBL7951219 | 0.73 | MTNR1A (0.59) | MTNR1ANQO2MTNR1BHTR2C | |
| SCHEMBL7950253 | 0.70 | MTNR1A (0.62) | TRPV1MTNR1ANQO2MTNR1B | |
| SCHEMBL16685001 | 0.70 | NPC1 (0.83) | NPC1RAB9A | |
| SCHEMBL2817474 | 0.70 | HTR2C (0.55) | MTNR1ANQO2MTNR1BADRB2HTR1A |
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-6235789-B1 | GLANDULAR DISORDERS; SLEEP DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-05-22 | — | — | US | disclosed |
| EP-0781271-A1 | BENZOCYCLOALKENE COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1997-07-02 | — | — | EP | disclosed |
| WO-1996008466-A1 | BENZOCYCLOALKENE COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-03-21 | — | — | WO | disclosed |