Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.50 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ELANE | P08246 | 3/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.39 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9794842 | 0.84 | ALDH1A1 (0.50) | ALDH1A1ELANEESR1HIF1ALTB4R | |
| SCHEMBL27698503 | 0.80 | ALDH1A1 (0.47) | ALDH1A1ELANEESR1HIF1ALTB4R | |
| SCHEMBL28329593 | 0.77 | ALDH1A1 (0.60) | ALDH1A1ELANELTB4RLTB4R2HPGD | |
| SCHEMBL6180016 | 0.76 | ELANE (0.50) | ALDH1A1ELANEESR1HIF1ALTB4R | |
| SCHEMBL666155 | 0.76 | POLB (0.47) | ALDH1A1ELANEHPGDALOX15HSD17B10 | |
| SCHEMBL1870721 | 0.74 | LMNA (0.50) | ALDH1A1ELANEHSD17B10NPC1RAB9A | |
| Phenol SCHEMBL9251256 | 0.73 | MIF (0.45) | ALDH1A1ELANEHPGDALOX15HSD17B10 | |
| SCHEMBL10481772 | 0.73 | ELANE (0.45) | ALDH1A1ELANEALOX15HSD17B10NPC1 | |
| SCHEMBL14507374 | 0.73 | ELANE (0.45) | ALDH1A1ELANEHPGDHSD17B10NPC1 | |
| SCHEMBL3079292 | 0.73 | ELANE (0.45) | ALDH1A1ELANEHSD17B10NPC1RAB9A |
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-4448730-A | ANTITUMOR AGENTS | RIET BARTHOLOMEUS VAN T | 1984-05-15 | — | — | US | disclosed |