Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 5/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 1/20 | 0.31 |
| ▸ | GRM3 | Q14832 | 3/20 | 0.31 |
| ▸ | GRM6 | O15303 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27548320 | 0.81 | CYP1A2 (0.40) | CYP1A2POLBGRM1GABRA5GABRB2 | |
| SCHEMBL27468265 | 0.77 | CYP1A2 (0.36) | CYP1A2POLBGRM2GRM5GRM1 | |
| SCHEMBL28255252 | 0.74 | — | — | |
| SCHEMBL27450939 | 0.72 | CYP1A2 (0.38) | CYP1A2POLBGRM2GRM5GRM1 | |
| SCHEMBL27468267 | 0.71 | CYP1A2 (0.41) | CYP1A2POLBGRM2GRM5GRM1 | |
| Glycine SCHEMBL28415998 | 0.67 | GLRA1 (0.50) | CYP1A2POLBGRM2GRM5GRM1 | |
| SCHEMBL8291577 | 0.66 | CYP1A2 (0.47) | CYP1A2POLBGABRA5GABRB2APLNR | |
| SCHEMBL27545369 | 0.65 | CYP1A2 (0.39) | CYP1A2POLBGRM2GRM5GRM1 | |
| SCHEMBL27618639 | 0.65 | POLB (0.38) | CYP1A2POLBGRM2GRM5GRM1 | |
| SCHEMBL15649927 | 0.64 | CYP1A2 (0.41) | CYP1A2POLBGRM2GRM5GRM1 |
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-1138755-C | Cyclic amino acids and derivatives thereof as pharmaceuticals | ��ʲ | 2004-02-18 | — | — | CN | disclosed |