Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 10/20 | 0.74 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.54 |
| ▸ | MPO | P05164 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | NQO2 | P16083 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.54 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL26989647 | 0.86 | MTNR1A (0.55) | MTNR1AMTNR1BKMT2AALDH1A1KDM4E | |
| SCHEMBL9121109 | 0.85 | MTNR1A (1.00) | MTNR1AMTNR1BKMT2AALDH1A1KDM4E | |
| SCHEMBL26989620 | 0.80 | HTR1D (0.59) | MTNR1AMTNR1BMPOHTR1A | |
| SCHEMBL26989666 | 0.78 | HTR2A (0.52) | MTNR1AMTNR1BHTR1A | |
| SCHEMBL21693925 | 0.78 | HTR1A (0.65) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL6930033 | 0.77 | MTNR1A (0.81) | MTNR1AMTNR1BKMT2AALDH1A1KDM4E | |
| SCHEMBL19244121 | 0.77 | MTNR1A (0.56) | MTNR1AMTNR1BKMT2AALDH1A1KDM4E | |
| SCHEMBL26826208 | 0.74 | MTNR1A (0.74) | MTNR1AMTNR1BKMT2AALDH1A1KDM4E | |
| SCHEMBL1972441 | 0.74 | USP2 (0.77) | MTNR1AKMT2AALDH1A1MEN1CYP1A2 | |
| SCHEMBL29991148 | 0.74 | USP2 (0.77) | MTNR1AKMT2AALDH1A1MEN1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020032080-A1 | COMPOUND, SALT OF COMPOUND, NEUROMODULATION AGENT, METHOD FOR EVALUATING NEUROMODULATION AGENT, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PRODUCING SALT OF COMPOUND | 学校法人慶應義塾 | 2020-02-13 | — | — | WO | disclosed |