Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | FBP1 | P09467 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | CDC7 | O00311 | 6/20 | 0.48 |
| ▸ | DBF4 | Q9UBU7 | 6/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL510662 | 0.88 | ALDH1A1 (0.62) | ALDH1A1HSD17B10CYP1A2FBP1HPGD | |
| SCHEMBL1505583 | 0.84 | ALDH1A1 (0.67) | ALDH1A1HSD17B10CYP1A2FBP1HPGD | |
| SCHEMBL18236334 | 0.82 | ALDH1A1 (0.69) | ALDH1A1HSD17B10CYP1A2FBP1HPGD | |
| SCHEMBL19782992 | 0.81 | DHODH (0.56) | ALDH1A1CYP1A2HPGDKDM4EMEN1 | |
| SCHEMBL19783118 | 0.79 | DHODH (0.48) | ALDH1A1CYP1A2HPGDKDM4EMEN1 | |
| SCHEMBL330552 | 0.79 | ALDH1A1 (1.00) | ALDH1A1HSD17B10CYP1A2FBP1HPGD | |
| SCHEMBL19782985 | 0.77 | DHODH (0.51) | ALDH1A1CYP1A2HPGDLMNAKDM4E | |
| SCHEMBL3406707 | 0.77 | ALDH1A1 (0.60) | ALDH1A1HSD17B10CYP1A2FBP1HPGD | |
| SCHEMBL29601738 | 0.76 | DHODH (0.50) | ALDH1A1CYP1A2HPGDLMNAKDM4E | |
| SCHEMBL27039803 | 0.76 | DHODH (0.50) | ALDH1A1CYP1A2HPGDLMNAKDM4E |
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-2018013508-A1 | SUBSTITUTED AMINOTHIAZOLES | BARUCH S. BLUMBERG INSTITUTE (US) | 2018-01-18 | — | — | WO | disclosed |