Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 6/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | TAS2R38 | P59533 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3067730 | 0.81 | GAA (0.86) | GAAKMT2AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL11583830 | 0.79 | SMN1; SMN2 (0.55) | KMT2AALDH1A1SMN1; SMN2MEN1MAPT | |
| SCHEMBL9352490 | 0.76 | IDO1 (0.51) | KMT2AALDH1A1HPGDSMN1; SMN2MEN1 | |
| SCHEMBL19891235 | 0.75 | ALDH1A1 (0.60) | GAAKMT2AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL3041278 | 0.75 | POLB (0.61) | GAAKMT2AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL19891238 | 0.75 | GAA (0.60) | GAAKMT2AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL11326932 | 0.75 | GAA (0.60) | GAAKMT2AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL19891157 | 0.74 | ALDH1A1 (0.58) | GAAKMT2AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL132620 | 0.73 | ALDH1A1 (1.00) | GAAKMT2AALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL2465758 | 0.73 | ALDH1A1 (0.64) | GAAKMT2AALDH1A1HPGDSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018035291-A1 | 1,2,4-TRIAZOLIDINE-3-THIONE DERIVATIVES AND USES THEREOF | NORTH CAROLINA STATE UNIVERSITY (US) | 2018-02-22 | — | — | WO | disclosed |