Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.52 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.52 |
| ▸ | TPMT | P51580 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | CASP1 | P29466 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SPR | P35270 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL111202 | 0.97 | AKR1C4 (0.54) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| SCHEMBL1301827 | 0.95 | AKR1C4 (0.52) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| Hydrochloric Acid SCHEMBL2512939 | 0.95 | AKR1C4 (0.52) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| SCHEMBL5878784 | 0.95 | AKR1C4 (0.52) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| Urea SCHEMBL29192961 | 0.90 | AKR1C4 (0.48) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| SCHEMBL8467899 | 0.83 | AKR1C4 (0.63) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| SCHEMBL29684531 | 0.83 | AKR1C4 (0.63) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| SCHEMBL5355330 | 0.83 | SPR (0.55) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| SCHEMBL348918 | 0.81 | CYP3A4 (0.53) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT | |
| SCHEMBL3765067 | 0.81 | SMN1; SMN2 (0.52) | AKR1C4AKR1C3AKR1C2AKR1C1TPMT |
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 |
|---|---|---|---|---|---|---|---|
| CN-111116617-A | 2,4, 6-terbium trichlorobenzoate complex/calcium carbonate composite fluorescent material and preparation method thereof | 阜阳师范学院 | 2020-05-08 | — | — | CN | disclosed |
| CN-111116617-A | 2,4, 6-terbium trichlorobenzoate complex/calcium carbonate composite fluorescent material and preparation method thereof | 阜阳师范学院 | 2020-05-08 | — | — | CN | disclosed |