Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.72 |
| ▸ | TP53 | P04637 | 3/20 | 0.72 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.72 |
| ▸ | TSHR | P16473 | 2/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | GMNN | O75496 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11344342 | 1.00 | CYP3A4 (0.72) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL6811786 | 1.00 | CYP3A4 (0.72) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL16240828 | 1.00 | CYP3A4 (0.72) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL5946843 | 0.96 | CYP3A4 (0.78) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL9722752 | 0.90 | CYP3A4 (0.78) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL11613963 | 0.89 | CYP3A4 (0.76) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL13412968 | 0.85 | CYP3A4 (0.63) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL16554142 | 0.84 | CYP3A4 (0.65) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL233589 | 0.84 | CYP3A4 (1.00) | CYP3A4TP53HSD17B10TSHRALDH1A1 | |
| SCHEMBL17963034 | 0.83 | CYP3A4 (0.71) | CYP3A4TP53HSD17B10TSHRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7365359-B2 | Organic semiconductor material and organic semiconductor element | DAI NIPPON PRINTING CO., LTD. (JP) | 2008-04-29 | — | — | US | disclosed |
| US-20040201011-A1 | Organic semiconductor material and organic semiconductor element | DAI NIPPON PRINTING CO., LTD. (JP) | 2004-10-14 | — | — | US | disclosed |