Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6156083 | 0.89 | ALDH1A1 (0.35) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL257997 | 0.69 | MAPT (0.64) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL14601731 | 0.68 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL990775 | 0.67 | ALDH1A1 (0.61) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL8999361 | 0.67 | KMT2A (0.47) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL28337230 | 0.67 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2RECQLKDM4EHPGD | |
| SCHEMBL14508493 | 0.66 | ALDH1A1 (0.50) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL9820117 | 0.66 | ALDH1A1 (0.59) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL9820058 | 0.65 | MAPT (0.61) | ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL6154551 | 0.65 | L3MBTL1 (0.37) | ALDH1A1CYP3A4KMT2AMEN1SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1027399-B1 | TRYPTICENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES, IN PARTICULAR AS ELECTROLUMINESCENT MATERIALS | COVION ORGANIC SEMICONDUCTORS (DE) | 2005-02-02 | — | — | EP | disclosed |
| EP-1027399-A1 | TRYPTICENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES, IN PARTICULAR AS ELECTROLUMINESCENT MATERIALS | Axiva GmbH (DE) | 2000-08-16 | — | — | EP | disclosed |
| WO-1999019419-A1 | TRYPTICENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES, IN PARTICULAR AS ELECTROLUMINESCENT MATERIALS | AXIVA GMBH (DE) | 1999-04-22 | — | — | WO | disclosed |