Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | HPGD | P15428 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5821178 | 0.84 | HIF1A (0.39) | ALDH1A1HPGDKDM4EHSD17B10ALOX15 | |
| SCHEMBL4907061 | 0.70 | EGFR (0.42) | ALDH1A1HPGDKDM4EHSD17B10ALOX15 | |
| SCHEMBL28860292 | 0.67 | ALDH1A1 (0.63) | ALDH1A1HPGDKDM4EALOX15USP2 | |
| SCHEMBL5813978 | 0.65 | KDM4E (0.38) | ALDH1A1KDM4ETP53MAPK1MAPT | |
| SCHEMBL5815540 | 0.65 | KDM4E (0.42) | ALDH1A1KDM4ELMNANPSR1MEN1 | |
| SCHEMBL7303075 | 0.65 | ALDH1A1 (0.65) | ALDH1A1HPGDKDM4EHSD17B10USP2 | |
| SCHEMBL12570448 | 0.60 | MEN1 (0.49) | ALDH1A1HPGDKDM4EHSD17B10ALOX15 | |
| SCHEMBL2498677 | 0.58 | MEN1 (0.60) | ALDH1A1HPGDKDM4EUSP2TDP1 | |
| SCHEMBL17241036 | 0.58 | ALDH1A1 (0.54) | ALDH1A1KDM4EALOX15USP2TDP1 | |
| SCHEMBL20460064 | 0.57 | ALDH1A1 (0.48) | ALDH1A1HPGDKDM4EHSD17B10ALOX15 |
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-2006112666-A1 | PYRIDINE DERIVATIVES, METHODS OF THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | SK CHEMICALS CO., LTD. (KR) | 2006-10-26 | — | — | WO | disclosed |