Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9380566 | 0.90 | HTT (0.65) | HTTALDH1A1TSHRATMSMN1; SMN2 | |
| SCHEMBL9380212 | 0.89 | HTT (0.63) | HTTALDH1A1TSHRATMSMN1; SMN2 | |
| SCHEMBL9384430 | 0.88 | ALDH1A1 (0.58) | ALDH1A1TSHRATML3MBTL1SMN1; SMN2 | |
| SCHEMBL29947318 | 0.82 | HTT (0.59) | HTTALDH1A1TSHRATMSMN1; SMN2 | |
| SCHEMBL3886220 | 0.79 | NPSR1 (0.67) | HTTALDH1A1ATMSMN1; SMN2NPSR1 | |
| SCHEMBL9384288 | 0.77 | ALDH1A1 (0.68) | HTTALDH1A1TSHRATML3MBTL1 | |
| SCHEMBL9221677 | 0.76 | HTT (0.67) | HTTALDH1A1ATMSMN1; SMN2NPSR1 | |
| SCHEMBL9380205 | 0.76 | ALDH1A1 (0.49) | HTTALDH1A1ATMSMN1; SMN2NPSR1 | |
| SCHEMBL9380381 | 0.75 | ALDH1A1 (0.45) | HTTALDH1A1TSHRATMSMN1; SMN2 | |
| SCHEMBL10366685 | 0.74 | ALDH1A1 (0.81) | HTTALDH1A1ATMSMN1; SMN2NPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0336494-B1 | Triazine herbicides | SHELL INT RESEARCH (NL) | 1994-06-29 | — | — | EP | disclosed |
| US-5062882-A | TRIAZINE HERBICIDES | SHELL INTERNATIONAL RESEARCH MAATSCHAPPIJ B. V. (NL) | 1991-11-05 | — | — | US | disclosed |
| EP-0336494-A2 | Triazine herbicides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-10-11 | — | — | EP | disclosed |