Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27807914 | 0.83 | ALDH1A1 (0.49) | POLBKMT2AALDH1A1RXFP1NR4A2 | |
| SCHEMBL3835940 | 0.83 | KMT2A (0.62) | KMT2ANPSR1ALDH1A1CYP1A2KDM4E | |
| SCHEMBL29911266 | 0.80 | BACE1 (0.46) | KMT2ANPSR1ALDH1A1RXFP1CYP3A4 | |
| SCHEMBL22304009 | 0.80 | NR4A2 (0.47) | POLBKMT2AALDH1A1RXFP1NR4A2 | |
| SCHEMBL12970077 | 0.80 | KMT2A (0.42) | KMT2ANPSR1ALDH1A1RXFP1CYP3A4 | |
| SCHEMBL3614209 | 0.80 | BACE1 (0.46) | KMT2ANPSR1ALDH1A1RXFP1CYP3A4 | |
| SCHEMBL6033527 | 0.77 | ALDH1A1 (0.64) | POLBKMT2AALDH1A1CYP1A2KDM4E | |
| SCHEMBL9730661 | 0.77 | KMT2A (0.44) | POLBKMT2ANPSR1ALDH1A1CYP3A4 | |
| SCHEMBL15314040 | 0.77 | KMT2A (0.44) | KMT2ANPSR1ALDH1A1CYP3A4CYP1A2 | |
| SCHEMBL7608692 | 0.77 | NR4A2 (0.52) | POLBKMT2AALDH1A1RXFP1NR4A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102491969-A | Heteroaromatic quinoline compounds | PFIZER PROD INC | 2012-06-13 | — | — | CN | disclosed |
| CN-101098866-A | Heteroaromatic quinoline compounds and their use as pde10 inhibitors | PFIZER (US) | 2008-01-02 | — | — | CN | disclosed |
| EP-0469833-B1 | N-Benzyl-Indoles, processes for their preparation and pharmaceutical compositions containing them | LILLY CO ELI (GB) | 1999-09-08 | — | — | EP | disclosed |
| EP-0469833-A1 | N-Benzyl-Indoles, processes for their preparation and pharmaceutical compositions containing them | LILLY INDUSTRIES LIMITED (GB) | 1992-02-05 | — | — | EP | disclosed |