Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | GABRE | P78334 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.33 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.33 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.33 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Ethane SCHEMBL28790777 | 0.81 | PDE10A (0.39) | CYP1A2TDP1ALDH1A1GABRPGABRD | |
| SCHEMBL13828658 | 0.78 | ALDH1A1 (0.36) | ALDH1A1HCAR2MAPTPOLBKDM4E | |
| SCHEMBL2743303 | 0.78 | EGLN1 (0.37) | ALDH1A1HCAR2MAPTPOLBKDM4E | |
| SCHEMBL10776549 | 0.78 | TDP1 (0.33) | CYP1A2TDP1ALDH1A1GABRPGABRD | |
| SCHEMBL2488690 | 0.77 | LMNA (0.36) | CYP1A2ALDH1A1KDM4EHPGDNUDT1 | |
| SCHEMBL10773190 | 0.75 | ALDH1A1 (0.34) | ALDH1A1HCAR2MAPTSMN1; SMN2 | |
| SCHEMBL1143403 | 0.75 | ALDH1A1 (0.40) | CYP1A2ALDH1A1PDE10AKDM4EHPGD | |
| SCHEMBL30420099 | 0.75 | ALDH1A1 (0.40) | CYP1A2ALDH1A1PDE10AKDM4EHPGD | |
| SCHEMBL10177617 | 0.72 | TDP1 (0.41) | TDP1ALDH1A1HCAR2POLBADORA2A | |
| SCHEMBL16963172 | 0.72 | MEN1 (0.46) | ALDH1A1HCAR2KMT2AKDM4EMEN1 |
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-4689328-A | CARBOXY-PYRIMIDINE DERIVATIVES | RESEARCH CORPORATION (US) | 1987-08-25 | — | — | US | disclosed |