Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.35 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.35 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.34 |
| ▸ | ABAT | P80404 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14192599 | 0.97 | MAPT (0.35) | NPC1MAPTRAB9AMCHR1SRD5A2 | |
| SCHEMBL14192517 | 0.90 | SRD5A1 (0.43) | NPC1MAPTRAB9ASRD5A2SRD5A1 | |
| SCHEMBL14192490 | 0.86 | LMNA (0.49) | NPC1MAPTCYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL14192562 | 0.83 | NPC1 (0.47) | NPC1MAPTCYP3A4KMT2ASMN1; SMN2 | |
| SCHEMBL14192558 | 0.83 | KMT2A (0.44) | NPC1MAPTRAB9AMCHR1SRD5A2 | |
| SCHEMBL5961812 | 0.83 | THRB (0.36) | NPC1MAPTRAB9AMCHR1KMT2A | |
| SCHEMBL14192546 | 0.83 | MAPT (0.48) | MAPTALDH5A1ABATCYP3A4KMT2A | |
| SCHEMBL14192470 | 0.82 | ALDH5A1 (0.46) | NPC1MAPTALDH5A1ABATCYP3A4 | |
| SCHEMBL14192469 | 0.82 | ALDH5A1 (0.46) | NPC1MAPTALDH5A1ABATCYP3A4 | |
| SCHEMBL14192587 | 0.82 | HTT (0.34) | MAPTALDH5A1ABATCYP3A4KMT2A |
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-7357964-B2 | Liquid-crystalline vinyl ketone derivatives and their polymers | CHISSO CORPORATION (JP) | 2008-04-15 | — | — | US | disclosed |