Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2892679 | 0.81 | PDGFRB (0.47) | ALDH1A1HTTMAPTNPC1RAB9A | |
| SCHEMBL3577096 | 0.81 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2TSHRHTTMAPT | |
| SCHEMBL22696464 | 0.79 | GRIN2D (0.41) | ALDH1A1SMN1; SMN2TSHRHTTKMT2A | |
| SCHEMBL5974463 | 0.76 | HTT (0.42) | ALDH1A1SMN1; SMN2TSHRHTTCASP1 | |
| SCHEMBL29025204 | 0.72 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TSHRHTTKMT2A | |
| SCHEMBL260778 | 0.72 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2TSHRHTTKMT2A | |
| SCHEMBL29462393 | 0.72 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2TSHRHTTKMT2A | |
| SCHEMBL28468281 | 0.71 | SIGMAR1 (0.45) | ALDH1A1SMN1; SMN2TSHRKMT2ACYP1A2 | |
| SCHEMBL1693396 | 0.71 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2TSHRHTTKMT2A | |
| SCHEMBL28263084 | 0.69 | NPC1 (0.51) | SMN1; SMN2TSHRCYP1A2CYP2C19MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2519524-A1 | CERTAIN TRIAZOLOPYRIDINES AND TRIAZOLOPYRAZINES, COMPOSITIONS THEREOF AND METHODS OF USE THEREFOR | Hutchison Medipharma Limited (CN) | 2012-11-07 | — | — | EP | disclosed |
| WO-2011079804-A1 | CERTAIN TRIAZOLOPYRIDINES AND TRIAZOLOPYRAZINES, COMPOSITIONS THEREOF AND METHODS OF USE THEREFOR | HUTCHISON MEDIPHARMA LIMITED (CN) | 2011-07-07 | — | — | WO | disclosed |