Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3R1 | P27986 | 2/20 | 0.48 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.48 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | RGS12 | O14924 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4949031 | 1.00 | PIK3R1 (0.48) | PIK3R1PIK3CAEDNRBMEN1ALDH1A1 | |
| SCHEMBL13993109 | 0.93 | PIK3R1 (0.47) | PIK3R1PIK3CAMEN1ALDH1A1MAPT | |
| SCHEMBL8168895 | 0.69 | HDAC3 (0.55) | MEN1ALDH1A1MAPTKMT2ATP53 | |
| SCHEMBL4946209 | 0.69 | PLA2G2A (0.47) | PIK3R1PIK3CAPLA2G2A | |
| SCHEMBL1626559 | 0.68 | CYP1A2 (0.63) | MEN1ALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL29812478 | 0.68 | CYP1A2 (0.63) | MEN1ALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL4946256 | 0.67 | PIK3R1 (0.37) | PIK3R1PIK3CAMEN1ALDH1A1MAPT | |
| SCHEMBL4946246 | 0.67 | PIK3R1 (0.37) | PIK3R1PIK3CAMEN1ALDH1A1MAPT | |
| SCHEMBL5017954 | 0.67 | PIK3R1 (0.49) | PIK3R1PIK3CAMEN1ALDH1A1MAPT | |
| SCHEMBL11459894 | 0.66 | MEN1 (0.51) | MEN1ALDH1A1MAPTMAPK1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2003129-B1 | 1H-Pyrido[3,4-B]indol-1-one and 2,3,4,9-Tetrahydro-1H-Beta-Carbolin-1-one Derivatives | NERVIANO MEDICAL SCIENCES SRL (IT) | 2017-08-09 | — | — | EP | disclosed |
| EP-2003129-A1 | 1H-Pyrido[3,4-B]indol-1-one and 2,3,4,9-Tetrahydro-1H-Beta-Carbolin-1-one Derivatives | Nerviano Medical Sciences S.r.l. (IT) | 2008-12-17 | — | — | EP | disclosed |