Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 16/20 | 0.55 |
| ▸ | MTNR1B | P49286 | 16/20 | 0.55 |
| ▸ | NQO2 | P16083 | 2/20 | 0.55 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.49 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30704310 | 1.00 | MTNR1A (0.55) | MTNR1AMTNR1BNQO2PLA2G2AROCK1 | |
| SCHEMBL6193835 | 0.77 | MTNR1A (0.66) | MTNR1AMTNR1BNQO2KDM4EALDH1A1 | |
| SCHEMBL18800052 | 0.75 | MTNR1A (0.64) | MTNR1AMTNR1BNQO2KDM4EALDH1A1 | |
| SCHEMBL4872843 | 0.74 | KDM4E (0.51) | PLA2G2AKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL6946915 | 0.71 | MTNR1A (0.59) | MTNR1AMTNR1BNQO2KDM4EALDH1A1 | |
| SCHEMBL8688610 | 0.71 | MTNR1A (0.75) | MTNR1AMTNR1BNQO2CYP1A2CYP3A4 | |
| SCHEMBL18239754 | 0.71 | HTR6 (0.57) | MTNR1AMTNR1BNQO2KDM4EALDH1A1 | |
| SCHEMBL3385793 | 0.68 | LTB4R (0.54) | PLA2G2AKDM4EALDH1A1 | |
| SCHEMBL6244274 | 0.68 | MTNR1A (0.74) | MTNR1AMTNR1B | |
| SCHEMBL28920689 | 0.68 | AKR1C3 (0.55) | MTNR1AMTNR1BNQO2ROCK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117343044-A | Synthesis method of 2-methyl-1- (pyridine-2-yl) indole compound | 太原理工大学 | 2024-01-05 | — | — | CN | disclosed |