Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 9/20 | 0.41 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.40 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29200857 | 0.82 | GRM1 (0.37) | GRM1CTSSCYP2D6 | |
| SCHEMBL30475254 | 0.82 | GRM1 (0.37) | GRM1CTSSCYP2D6 | |
| SCHEMBL3104046 | 0.81 | L3MBTL1 (0.45) | GRM1MEN1HTTKMT2AGRM5 | |
| SCHEMBL30585788 | 0.77 | GRM1 (0.51) | GRM1GRM5CYP3A4CYP2D6KDM4E | |
| SCHEMBL10353108 | 0.75 | ELANE (0.49) | GRM1OPRK1MEN1HTTKMT2A | |
| SCHEMBL31028552 | 0.75 | ELANE (0.49) | GRM1OPRK1MEN1HTTKMT2A | |
| SCHEMBL29200952 | 0.75 | KDM4E (0.60) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| SCHEMBL29200928 | 0.74 | CTSS (0.33) | CTSS | |
| Hydrochloric Acid SCHEMBL29659031 | 0.74 | ELANE (0.48) | GRM1OPRK1MEN1HTTKMT2A | |
| SCHEMBL3635138 | 0.73 | GRM1 (0.36) | GRM1PBRM1NR1I2ADRA1AADRA1B |
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-116332905-A | (S) -N-phenyl-1- (pyridin-2-yl) pyrrolidine-2-carboxamide derivatives | 上海翊石医药科技有限公司 | 2023-06-27 | — | — | CN | disclosed |