Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2266753 | 0.85 | GRM6 (0.46) | KMT2AALDH1A1LTA4HMAPTHTT | |
| SCHEMBL2266748 | 0.85 | GRM6 (0.46) | KMT2AALDH1A1LTA4HMAPTHTT | |
| SCHEMBL8064264 | 0.81 | LTA4H (0.55) | KMT2AALDH1A1LTA4HMAPT | |
| SCHEMBL1810781 | 0.81 | LTA4H (0.55) | KMT2AALDH1A1LTA4HMAPT | |
| SCHEMBL4230862 | 0.80 | SLC1A5 (0.47) | KMT2AALDH1A1LTA4HMAPTHTT | |
| SCHEMBL20278607 | 0.79 | KMT2A (0.60) | KMT2ASMN1; SMN2ALDH1A1RAB9ANPC1 | |
| SCHEMBL27615557 | 0.78 | LTA4H (0.44) | ALDH1A1RAB9ANPC1ELANELTA4H | |
| SCHEMBL1818825 | 0.77 | LTA4H (0.55) | KMT2ASMN1; SMN2ALDH1A1LTA4HMAPT | |
| SCHEMBL9222833 | 0.77 | PDE4B (0.58) | KMT2AALDH1A1RAB9ANPC1LTA4H | |
| SCHEMBL10425785 | 0.76 | LTA4H (0.38) | KMT2ASMN1; SMN2ALDH1A1ELANEESR1 |
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-3286182-A1 | TETRAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS | F. Hoffmann-La Roche AG (CH) | 2018-02-28 | — | — | EP | disclosed |
| WO-2016169902-A1 | TETRAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS | F. HOFFMANN-LA ROCHE AG (CH) | 2016-10-27 | — | — | WO | disclosed |