Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 2/20 | 0.30 |
| ▸ | GABRD | O14764 | 2/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.30 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27618521 | 0.83 | AKR1B1 (0.34) | AKR1B1 | |
| SCHEMBL27617099 | 0.81 | CYP1A2 (0.36) | POLBGRM1CYP1A2ALDH1A1TSHR | |
| SCHEMBL5443231 | 0.77 | ALDH1A1 (0.48) | POLBGRM1CYP1A2ALDH1A1TSHR | |
| SCHEMBL5436605 | 0.77 | ALDH1A1 (0.48) | POLBGRM1CYP1A2ALDH1A1TSHR | |
| SCHEMBL5436601 | 0.77 | ALDH1A1 (0.48) | POLBGRM1CYP1A2ALDH1A1TSHR | |
| SCHEMBL27618639 | 0.73 | POLB (0.38) | POLBGRM2GRM1GRM5CYP1A2 | |
| SCHEMBL27618524 | 0.72 | POLB (0.37) | POLBGRM2GRM1GRM5CYP1A2 | |
| SCHEMBL22432918 | 0.72 | SLC22A2 (0.31) | — | |
| SCHEMBL3837864 | 0.71 | POLB (0.43) | POLBGRM2GRM1GRM5CYP1A2 | |
| SCHEMBL5434568 | 0.68 | ALDH1A1 (0.47) | POLBCYP1A2ALDH1A1TSHRSMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100367946-C | Gabapentin analogs for the treatment of fibromyalgia and other disorders | WARNER LAMBERT CO (US) | 2008-02-13 | — | — | CN | disclosed |
| CN-1720038-A | Gabapentin analogs for the treatment of fibromyalgia and other disorders | WARNER LAMBERT CO (US) | 2006-01-11 | — | — | CN | disclosed |