Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP14 | Q460N5 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 3/20 | 0.46 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12279151 | 0.85 | MAPT (0.51) | MAPTNPSR1HTTPKMPDE7A | |
| SCHEMBL18614110 | 0.76 | MAPT (0.41) | MAPTKMT2APOLBMEN1SLC9A1 | |
| SCHEMBL18647211 | 0.74 | ALDH1A1 (0.45) | MAPTKMT2APOLBMEN1SLC9A1 | |
| SCHEMBL645403 | 0.73 | RXFP1 (0.58) | MAPTNPSR1HTTPKMPDE7A | |
| SCHEMBL9507659 | 0.73 | ALDH1A1 (0.49) | MAPTKDM4E | |
| SCHEMBL28124654 | 0.72 | KDM4E (0.55) | PARP14MAPTKMT2AKDM4EMEN1 | |
| SCHEMBL5106815 | 0.72 | MAPT (0.65) | PARP14MAPTNPSR1KMT2AKDM4E | |
| SCHEMBL733777 | 0.71 | KMT2A (0.69) | MAPTNPSR1HTTPKMPDE7A | |
| SCHEMBL29740651 | 0.71 | KMT2A (0.69) | MAPTNPSR1HTTPKMPDE7A | |
| SCHEMBL11147829 | 0.70 | TDP1 (0.60) | MAPTNPSR1HTTPKMPDE7A |
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-0399293-B1 | PROCESS FOR PREPARING 2-CHLORO-4-NITRO-ALKYLBENZENE | BAYER AG (DE) | 1993-09-01 | — | — | EP | disclosed |
| US-5095157-A | Friedel-crafts catalyst | BAYER AKTIENGESELLSCHAFT (DE) | 1992-03-10 | — | — | US | disclosed |
| EP-0399293-A1 | Process for preparing 2-chloro-4-nitro-alkylbenzene | BAYER AG (DE) | 1990-11-28 | — | — | EP | disclosed |