Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.62 |
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | ESRRG | P62508 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | MLYCD | O95822 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | ESRRB | O95718 | 1/20 | 0.51 |
| ▸ | ALPL | P05186 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14865706 | 0.89 | ALDH1A1 (0.65) | RAB9ANPC1ESRRGALDH1A1LMNA | |
| SCHEMBL14859488 | 0.85 | ALDH1A1 (0.64) | RAB9ANPC1ESRRGALDH1A1LMNA | |
| SCHEMBL10480438 | 0.85 | LMNA (0.72) | RAB9AALDH1A1LMNAPOLBGAA | |
| SCHEMBL14859224 | 0.81 | ALDH1A1 (0.77) | RAB9ANPC1ESRRGALDH1A1LMNA | |
| SCHEMBL11952643 | 0.77 | RAB9A (1.00) | RAB9ANPC1ESRRGLMNATMEM97 | |
| SCHEMBL23068164 | 0.76 | ALDH1A1 (0.83) | RAB9ANPC1ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL17372600 | 0.76 | RAB9A (0.80) | RAB9ANPC1ESRRGLMNATMEM97 | |
| SCHEMBL14859851 | 0.76 | POLB (0.71) | RAB9ANPC1ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL14860323 | 0.75 | RAB9A (0.57) | RAB9ANPC1ESRRGALDH1A1LMNA | |
| SCHEMBL14859533 | 0.72 | SCN5A (0.70) | RAB9ANPC1ALDH1A1LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-1989006125-A1 | 4-ARALKYL-5-SUBSTITUTED-1,2,4-TRIAZOLE-5-THIOLS | SMITHKLINE BECKMAN CORPORATION (US) | 1989-07-13 | — | — | WO | disclosed |
| EP-0323737-A1 | 4-Aralkyl-5-substituted-1,2,4-triazole-5-thiols | SMITHKLINE BEECHAM CORPORATION (US) | 1989-07-12 | — | — | EP | disclosed |