Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL840862 | 0.79 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL3817810 | 0.75 | ALDH1A1 (0.39) | ALDH1A1CYP2C19 | |
| SCHEMBL20104687 | 0.73 | TP53 (0.35) | ALDH1A1TP53TSHRNFKB1CYP2C19 | |
| SCHEMBL9819458 | 0.72 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL10225361 | 0.69 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL9819380 | 0.69 | CTSK (0.33) | KDM4EATM | |
| SCHEMBL17294312 | 0.69 | TP53 (0.32) | ALDH1A1TP53 | |
| SCHEMBL10177532 | 0.67 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL2862637 | 0.67 | KDM4E (0.32) | ALDH1A1KDM4EATMTSHR | |
| SCHEMBL840304 | 0.67 | ALDH1A1 (0.32) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8143443-B2 | Process for preparing gabapentin | ZACH SYSTEM S.P.A. (IT) | 2012-03-27 | — | — | US | disclosed |