Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KDM6B | O15054 | 1/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Isoquinoline SCHEMBL28075529 | 0.81 | P2RX4 (0.38) | MEN1KMT2AP2RX4CYP3A4 | |
| SCHEMBL29376182 | 0.76 | P2RX4 (0.44) | MEN1KMT2AP2RX4 | |
| SCHEMBL3375661 | 0.76 | P2RX4 (0.44) | MEN1KMT2AP2RX4 | |
| SCHEMBL14494876 | 0.74 | GAA (0.34) | MAPTGAACYP3A4 | |
| SCHEMBL4780802 | 0.73 | P2RX4 (0.37) | TDP1CYP11B2P2RX4 | |
| SCHEMBL28643773 | 0.72 | CYP2A6 (0.33) | — | |
| SCHEMBL28939506 | 0.71 | — | — | |
| Quinoline SCHEMBL28157604 | 0.69 | ALDH1A1 (0.44) | KDM4EALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL31613275 | 0.69 | — | — | |
| Isoquinoline SCHEMBL28191779 | 0.68 | LMNA (0.40) | KDM4ECYP11B2P2RX4 |
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-1716146-A1 | PYRROLOQUINOLINE AND PIPERIDOQUINOLINE DERIVATIVES, PREPARATION THEREOF, COMPOSITIONS CONTAINING THEM AND USES THEREOF | AstraZeneca AB (SE) | 2006-11-02 | — | — | EP | disclosed |
| WO-2005075476-A1 | PYRROLOQUINOLINE AND PIPERIDOQUINOLINE DERIVATIVES, PREPARATION THEREOF, COMPOSITIONS CONTAINING THEM AND USES THEREOF | ASTRAZENECA AB (SE) | 2005-08-18 | — | — | WO | disclosed |