Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | BCR | P11274 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL8927712 | 0.89 | HSD17B2 (0.41) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL8927629 | 0.88 | ALDH1A1 (0.41) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL8927611 | 0.87 | APP (0.37) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL9242278 | 0.87 | ALDH1A1 (0.41) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL21979758 | 0.87 | ALDH1A1 (0.41) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL9427929 | 0.85 | CYP1A2 (0.38) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL14570743 | 0.85 | ACHE (0.42) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL10128556 | 0.83 | CYP1A2 (0.39) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL8927301 | 0.83 | APP (0.41) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 | |
| SCHEMBL8927741 | 0.81 | CYP3A4 (0.41) | ALDH1A1HPGDTSHRL3MBTL1CYP3A4 |
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-5631404-A | DIAMINE COMPOUND SUBSTITUTED WITH PYRENE RING, FLEXIBILITY | RICOH COMPANY, LTD. (JP) | 1997-05-20 | — | — | US | disclosed |
| US-5489495-A | Electrophotographic photoconductor and diamine compounds for use in the same | RICHOH COMPANY, LTD. (JP) | 1996-02-06 | — | — | US | disclosed |