Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL9507662 | 0.86 | GAA (0.36) | GAAABL1NQO2ALDH1A1KDM4E | |
| SCHEMBL522450 | 0.73 | GAA (0.49) | GAAABL1NQO2KDM4EMEN1 | |
| SCHEMBL9510067 | 0.70 | AHR (0.35) | MEN1KMT2ACYP3A4HPGD | |
| SCHEMBL1706798 | 0.67 | GAA (0.53) | GAAABL1NQO2ALDH1A1KDM4E | |
| SCHEMBL11697659 | 0.66 | NR4A2 (0.41) | GAAABL1NQO2KDM4EMEN1 | |
| SCHEMBL8331805 | 0.64 | GAA (0.51) | GAAABL1NQO2KDM4EMEN1 | |
| SCHEMBL31147102 | 0.64 | GAA (0.51) | GAAABL1NQO2ALDH1A1KDM4E | |
| SCHEMBL9511428 | 0.63 | GAA (0.36) | GAAALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL1953848 | 0.63 | GAA (0.58) | GAAABL1ALDH1A1KDM4EMEN1 | |
| SCHEMBL70011 | 0.63 | GAA (0.58) | GAAABL1ALDH1A1KDM4EMEN1 |
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-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 |