Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7902230 | 1.00 | TSHR (0.35) | TSHRLMNATRPA1SIGMAR1SMN1; SMN2 | |
| SCHEMBL7902830 | 1.00 | TSHR (0.35) | TSHRLMNATRPA1SIGMAR1SMN1; SMN2 | |
| SCHEMBL7902835 | 1.00 | TSHR (0.35) | TSHRLMNATRPA1SIGMAR1SMN1; SMN2 | |
| SCHEMBL7904039 | 0.74 | TDP1 (0.31) | ALDH1A1TDP1 | |
| SCHEMBL7894972 | 0.74 | TDP1 (0.31) | ALDH1A1TDP1 | |
| SCHEMBL7894971 | 0.74 | TDP1 (0.31) | ALDH1A1TDP1 | |
| SCHEMBL2305563 | 0.67 | LMNA (0.38) | TSHRLMNATRPA1SIGMAR1TP53 | |
| SCHEMBL6569417 | 0.67 | LMNA (0.38) | TSHRLMNATRPA1SIGMAR1TP53 | |
| SCHEMBL16361534 | 0.67 | LMNA (0.38) | TSHRLMNATRPA1SIGMAR1TP53 | |
| SCHEMBL2555038 | 0.65 | SMN1; SMN2 (0.35) | TSHRSIGMAR1SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6194593-B1 | USEFUL AS LIGAND FOR AN ASYMMETRIC CATALYST FOR USE IN ASYMMETRICAL HYDROGENATION | NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) | 2001-02-27 | — | — | US | disclosed |