Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 6/20 | 0.73 |
| ▸ | NR1H3 | Q13133 | 6/20 | 0.73 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10476799 | 0.84 | NR1H2 (1.00) | NR1H2NR1H3TSHRCYP1A2SMN1; SMN2 | |
| SCHEMBL17570200 | 0.83 | NR1H2 (0.97) | NR1H2NR1H3TSHRCYP1A2SMN1; SMN2 | |
| SCHEMBL17279678 | 0.80 | NR1H2 (0.85) | NR1H2NR1H3TSHRCYP1A2HSD17B10 | |
| SCHEMBL10476808 | 0.79 | NR1H2 (1.00) | NR1H2NR1H3TSHRCYP1A2SMN1; SMN2 | |
| SCHEMBL17570201 | 0.77 | NR1H2 (0.85) | NR1H2NR1H3TSHRCYP1A2SMN1; SMN2 | |
| SCHEMBL11272510 | 0.74 | NR1H2 (0.76) | NR1H2NR1H3TSHRCYP1A2SMN1; SMN2 | |
| SCHEMBL17279824 | 0.74 | NR1H2 (0.76) | NR1H2NR1H3TSHRCYP1A2SMN1; SMN2 | |
| SCHEMBL679761 | 0.71 | NR1H3 (0.68) | NR1H2NR1H3TSHRHSD17B10LMNA | |
| SCHEMBL15157116 | 0.70 | TSHR (0.49) | NR1H2NR1H3TSHRCYP1A2HSD17B10 | |
| SCHEMBL1386265 | 0.69 | NR1H2 (0.51) | NR1H2NR1H3TSHRSMN1; SMN2HSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4332812-A | ANTIARTHRITIC | E. R. SQUIBB & SONS, INC. (US) | 1982-06-01 | — | — | US | disclosed |
| EP-0003895-A1 | 1-Acyl-3(5)-alkyl-5(3)-phenyl-1,2,4-triazoles, process for their preparation and pharmaceutical compositions containing them | E.R. Squibb & Sons, Inc. (US) | 1979-09-05 | — | — | EP | disclosed |
| US-4154843-A | Method of treating psychotic states with 1-acyl-3(5)-alkyl-5(3)-phenyl-1,2,4-triazoles | E. R. SQUIBB & SONS, INC. (US) | 1979-05-15 | — | — | US | disclosed |
| US-4154841-A | Antiinflammatory 1-acyl-3(5)-alkyl-5(3)-phenyl-1,2,4-triazoles | E. R. SQUIBB & SONS, INC. (US) | 1979-05-15 | — | — | US | disclosed |