Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | GBA1 | P04062 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | PRKCI | P41743 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | AGER | Q15109 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29578557 | 0.86 | ATR (0.53) | ATRL3MBTL1GBA1NAPRTGRM5 | |
| SCHEMBL65106 | 0.86 | ATR (0.53) | ATRL3MBTL1GBA1NAPRTGRM5 | |
| Hydrochloric Acid SCHEMBL29522091 | 0.84 | ATR (0.52) | ATRL3MBTL1GBA1NAPRTGRM5 | |
| Water SCHEMBL28289088 | 0.84 | ATR (0.52) | ATRL3MBTL1GBA1NAPRTGRM5 | |
| Bicarbonate SCHEMBL27990026 | 0.79 | ATR (0.47) | ATRL3MBTL1GBA1NAPRTGRM5 | |
| Pyrrole SCHEMBL11786833 | 0.75 | GRM5 (0.47) | ATRGRM5ALDH1A1PIM1PIM3 | |
| Quinolinic Acid SCHEMBL28320479 | 0.73 | KDM4E (0.79) | L3MBTL1NAPRTKDM4EMAPTALDH1A1 | |
| Pyrazinoic Acid SCHEMBL9616231 | 0.71 | KDM4E (0.69) | ATRL3MBTL1NAPRTGRM5PRKCI | |
| SCHEMBL27669301 | 0.71 | PRKCI (0.50) | ATRL3MBTL1GBA1NAPRTGRM5 | |
| SCHEMBL69939 | 0.70 | KDM4E (0.54) | L3MBTL1NAPRTKDM4EMAPTALDH1A1 |
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-3954753-A | SEDATIVES, MUSCLE RELAXANTS, ANTICONVULSANTS | HOFFMANN-LA ROCHE INC. (US) | 1976-05-04 | — | — | US | disclosed |