Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 4/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL11475669 | 0.69 | PIN1 (0.37) | ALDH1A1TSHRGLAMAPTL3MBTL1 | |
| SCHEMBL3684648 | 0.69 | TSHR (0.35) | TP53PSIP1ALDH1A1CES2CES1 | |
| SCHEMBL17963728 | 0.69 | TSHR (0.35) | TP53PSIP1ALDH1A1CES2CES1 | |
| SCHEMBL11288437 | 0.68 | CA4 (0.38) | TP53ALDH1A1CES2CES1TSHR | |
| SCHEMBL17400778 | 0.65 | LMNA (0.32) | TSHRLMNAALOX12ACHE | |
| Propionic Acid SCHEMBL9312830 | 0.65 | FFAR3 (0.56) | ALDH1A1CES2CES1TSHRGLA | |
| SCHEMBL11222508 | 0.63 | CA4 (0.32) | TSHRLMNAALOX12ACHE | |
| SCHEMBL10639940 | 0.63 | NPSR1 (0.38) | TP53ALDH1A1CES2CES1TSHR | |
| SCHEMBL278265 | 0.63 | TSHR (0.39) | ALDH1A1CES2CES1TSHRGLA | |
| SCHEMBL6003247 | 0.63 | BBOX1 (0.33) | ALDH1A1CES2CES1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996001811-A1 | 2-SUBSTITUTED 1,25-DIHYDROXYVITAMIN D3 DERIVATIVES | THE JOHNS-HOPKINS UNIVERSITY (US) | 1996-01-25 | — | — | WO | disclosed |