Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 6/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28243676 | 1.00 | ALDH1A1 (0.44) | ALDH1A1TSHRHPGDATMMAPT | |
| SCHEMBL18704240 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TSHRHPGDATMHCAR2 | |
| SCHEMBL28242894 | 0.81 | MEN1 (0.53) | ALDH1A1TSHRHPGDMAPTLMNA | |
| SCHEMBL28242892 | 0.81 | MEN1 (0.53) | ALDH1A1TSHRHPGDMAPTLMNA | |
| SCHEMBL27869320 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TSHRHPGDATMMAPT | |
| SCHEMBL3412121 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TSHRHPGDATMMAPT | |
| SCHEMBL862703 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRHPGDATMHCAR2 | |
| SCHEMBL8397276 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRHPGDATMHCAR2 | |
| Hydrochloric Acid SCHEMBL18492368 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TSHRHPGDATMMAPT | |
| SCHEMBL9286243 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TSHRHPGDATMMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108586488-B | Photocatalytic synthesis method of Diels-Alder adduct as intermediate of vitamin B6 | 浙江新和成股份有限公司 | 2020-05-12 | — | — | CN | disclosed |
| CN-108586488-A | A kind of photocatalytic synthesis method of vitamin B6 intermediate Diels-Alder addition products | 浙江新和成股份有限公司 | 2018-09-28 | — | — | CN | disclosed |
| EP-1157004-A1 | REGIOSELECTIVE SYNTHESIS OF DTPA DERIVATIVES | IDEC PHARMACEUTICALS CORPORATION (US) | 2001-11-28 | — | — | EP | disclosed |
| WO-2000051976-A1 | REGIOSELECTIVE SYNTHESIS OF DTPA DERIVATIVES | IDEC PHARMACEUTICALS CORPORATION (US) | 2000-09-08 | — | — | WO | disclosed |