Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tiratricol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB known ✓ | P10828 | 12/20 | 0.77 |
| ▸ | THRA known ✓ | P10827 | 10/20 | 0.77 |
| ▸ | PCNA | P12004 | 8/20 | 0.77 |
| ▸ | PPARG | P37231 | 4/20 | 0.77 |
| ▸ | LMNA | P02545 | 4/20 | 0.77 |
| ▸ | POLB | P06746 | 3/20 | 0.77 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.77 |
| ▸ | RXRA | P19793 | 2/20 | 0.77 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.77 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.77 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.77 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.77 |
| ▸ | HPGD | P15428 | 2/20 | 0.77 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.77 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.77 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.77 |
| ▸ | PGR | P06401 | 1/20 | 0.77 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.77 |
| ▸ | HTR1A | P08908 | 1/20 | 0.77 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.77 |
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 | |
|---|---|---|---|---|
| Tiratricol SCHEMBL25149 | 0.88 | THRB (1.00) | THRBTHRAPCNAPPARGLMNA | |
| Tiratricol SCHEMBL743426 | 0.88 | THRB (1.00) | THRBTHRAPCNAPPARGLMNA | |
| Tiratricol SCHEMBL30161572 | 0.88 | THRB (1.00) | THRBTHRAPCNAPPARGLMNA | |
| Tiratricol SCHEMBL2671904 | 0.87 | THRB (0.97) | THRBTHRAPCNAPPARGLMNA | |
| Tiratricol SCHEMBL8660328 | 0.87 | THRB (0.97) | THRBTHRAPCNAPPARGLMNA | |
| Tiratricol SCHEMBL10701956 | 0.87 | THRB (0.97) | THRBTHRAPCNAPPARGLMNA | |
| SCHEMBL18573065 | 0.84 | THRB (0.82) | THRBTHRAPCNAPPARGLMNA | |
| Tiratricol SCHEMBL21624999 | 0.82 | THRB (0.77) | THRBTHRAPCNAPPARGLMNA | |
| SCHEMBL14485277 | 0.81 | THRB (0.77) | THRBTHRAPCNAPPARGLMNA | |
| Tiratricol SCHEMBL5881667 | 0.81 | THRB (0.81) | THRBTHRAPCNAPPARGLMNA |
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-0586615-A1 | TIN CATALYSTS FOR HYDROLYSIS OF LATENT AMINE CURING AGENTS. | GRACE W R & CO (US) | 1994-03-16 | — | — | EP | disclosed |
| WO-1992018551-A1 | TIN CATALYSTS FOR HYDROLYSIS OF LATENT AMINE CURING AGENTS | W. R. GRACE & CO.-CONN. (US) | 1992-10-29 | — | — | WO | disclosed |