Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.65 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27729377 | 0.85 | SLC22A6 (0.74) | SLC22A6SMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL4624292 | 0.83 | SLC22A6 (0.71) | SLC22A6PKMSMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL352798 | 0.81 | SLC22A6 (0.69) | SLC22A6PKMSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL148210 | 0.80 | SLC22A6 (0.67) | SLC22A6PKMSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL28113890 | 0.80 | SLC22A6 (0.67) | SLC22A6PKMSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL29199780 | 0.79 | SLC22A6 (0.61) | SLC22A6PKMSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL28747978 | 0.79 | SLC22A6 (0.61) | SLC22A6PKMSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL29199798 | 0.79 | SLC22A6 (0.61) | SLC22A6PKMSMN1; SMN2CYP1A2CYP3A4 | |
| Indole Acetate SCHEMBL15553 | 0.79 | SLC22A6 (1.00) | SLC22A6PKMSMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL11350789 | 0.79 | SLC22A6 (0.53) | SLC22A6PKMSMN1; SMN2CYP1A2CYP3A4 |
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-2343291-A1 | 3-(Indolyl)- or 3-(Azaindolyl)-4-arylmaleimide compounds and their use in tumor treatment | Johannes Gutenberg-Universität Mainz (DE) | 2011-07-13 | — | — | EP | disclosed |
| EP-0716077-A1 | Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors | CIBA-GEIGY AG (CH) | 1996-06-12 | — | — | EP | disclosed |
| EP-0702004-A2 | 2,9-diamino- and 2-amino-8-carbamoyl-4-hydroxy-alkanoic acid amid derivatives | CIBA-GEIGY AG (CH) | 1996-03-20 | — | — | EP | disclosed |