Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL25263151 | 0.82 | ALDH1A1 (0.44) | TSHRTDP1ALDH1A1HIF1AGAA | |
| SCHEMBL21644480 | 0.81 | TSHR (0.62) | S1PR4TSHRTDP1ALDH1A1HIF1A | |
| SCHEMBL2144346 | 0.80 | S1PR4 (0.52) | S1PR4TSHRTDP1ALDH1A1HIF1A | |
| SCHEMBL29400372 | 0.80 | S1PR4 (0.52) | S1PR4TSHRTDP1ALDH1A1HIF1A | |
| SCHEMBL27038495 | 0.80 | TSHR (0.53) | S1PR4TSHRTDP1ALDH1A1HIF1A | |
| SCHEMBL15546554 | 0.80 | ALDH1A1 (0.50) | TSHRTDP1ALDH1A1HIF1AGAA | |
| SCHEMBL8926446 | 0.79 | ALDH1A1 (0.49) | S1PR4TSHRTDP1ALDH1A1HIF1A | |
| SCHEMBL16848696 | 0.79 | CYP19A1 (0.61) | S1PR4TSHRTDP1ALDH1A1HIF1A | |
| SCHEMBL28674578 | 0.78 | CHRNB2 (0.58) | TSHRALDH1A1 | |
| SCHEMBL25189851 | 0.77 | RAB9A (0.50) | S1PR4TSHRTDP1ALDH1A1HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115151252-A | Iron death inhibitors diarylamine para-acetamides | 维泰瑞隆有限公司 | 2022-10-04 | — | — | CN | disclosed |