Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 10/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 10/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TYMS | P04818 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL2240250 | 1.00 | MTNR1A (0.47) | MTNR1AMTNR1BCYP3A4TSHRKDM4E | |
| SCHEMBL345448 | 1.00 | MTNR1A (0.47) | MTNR1AMTNR1BCYP3A4TSHRKDM4E | |
| Benzene SCHEMBL27878569 | 0.98 | MTNR1A (0.46) | MTNR1AMTNR1BCYP3A4TSHRKDM4E | |
| SCHEMBL28566029 | 0.78 | MTNR1A (0.36) | MTNR1AMTNR1BCYP3A4TSHRKDM4E | |
| SCHEMBL10615648 | 0.77 | MTNR1A (0.47) | MTNR1AMTNR1BCYP3A4TSHRKDM4E | |
| Hydrochloric Acid SCHEMBL10615425 | 0.76 | MTNR1A (0.46) | MTNR1AMTNR1B | |
| SCHEMBL345447 | 0.75 | MTNR1A (0.47) | MTNR1AMTNR1BCYP3A4TSHRKDM4E | |
| SCHEMBL2244164 | 0.75 | MTNR1A (0.44) | MTNR1AMTNR1BCYP3A4TSHRADRA2A | |
| SCHEMBL853343 | 0.75 | MTNR1A (0.44) | MTNR1AMTNR1BCYP3A4TSHRKDM4E | |
| SCHEMBL22417220 | 0.75 | MTNR1A (0.44) | MTNR1AMTNR1BCYP3A4TSHRKDM4E |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106397116-A | 1-acenaphthenol synthesis and enantiomer separation method | 王际菊 | 2017-02-15 | — | — | CN | claimed |
| CN-106397116-A | 1-acenaphthenol synthesis and enantiomer separation method | 王际菊 | 2017-02-15 | — | — | CN | disclosed |
| CN-106397116-A | 1-acenaphthenol synthesis and enantiomer separation method | 王际菊 | 2017-02-15 | — | — | CN | disclosed |
| EP-0856514-B1 | 8-substituted-1,3,8-triazaspiro[4.5]decan-4-on derivatives | HOFFMANN LA ROCHE (CH) | 2001-06-13 | — | — | EP | disclosed |
| US-6071925-A | ANTIDEPRESSANTS, ANTICONVULSANTS OR ANTIANXIETY AGENTS, ALSO FOR TREATMENT OF MEMORY LOSS IN ALZHEIMER'S DISEASE | HOFFMANN-LA ROCHE INC. (US) | 2000-06-06 | — | — | US | disclosed |
| EP-0856514-A1 | 8-substituted-1,3,8-triazaspiro[4.5]decan-4-on derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1998-08-05 | — | — | EP | disclosed |