Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | APP | P05067 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL11606808 | 0.80 | PKM (0.65) | NPC1MAPTHTTALDH1A1PKM | |
| SCHEMBL11601837 | 0.80 | PPARA (0.45) | PPARANPC1MAPTHTTPKM | |
| SCHEMBL11605260 | 0.80 | KMT2A (0.58) | RAB9ANPC1MAPTHTTALDH1A1 | |
| SCHEMBL11604954 | 0.80 | SMN1; SMN2 (0.50) | RAB9ANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11602024 | 0.79 | ALDH1A1 (0.56) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL11606470 | 0.78 | SMN1; SMN2 (0.41) | NPC1MAPTHTTALDH1A1PKM | |
| SCHEMBL11605659 | 0.74 | DYRK1A (0.43) | PPARANPC1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11601529 | 0.74 | SMN1; SMN2 (0.57) | PPARARAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL1622148 | 0.73 | KEAP1 (0.65) | PPARARAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL31038152 | 0.72 | PPARA (0.51) | PPARARAB9ANPC1CYP1A2CYP3A4 |
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-4096111-A | (BENZOTHIAZOLYL-THIO)-SUBSTITUTED ANTHRAQUINONES | BAYER AKTIENGESELLSCHAFT (DT) | 1978-06-20 | — | — | US | disclosed |