Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11318911 | 0.84 | CYP1A2 (0.41) | CYP1A2ALDH1A1MAPTTDP1KDM4E | |
| SCHEMBL8661325 | 0.82 | CYP1A2 (0.39) | CYP1A2ALDH1A1MAPTTDP1KDM4E | |
| SCHEMBL11524922 | 0.80 | MAPT (0.41) | CYP1A2ALDH1A1MAPTTDP1KMT2A | |
| SCHEMBL8371130 | 0.79 | VCAM1 (0.39) | CYP1A2ALDH1A1MAPTTDP1KMT2A | |
| SCHEMBL10792911 | 0.76 | CYP1A2 (0.44) | CYP1A2ALDH1A1MAPTTDP1KMT2A | |
| SCHEMBL10815711 | 0.74 | MAPK1 (0.50) | ALDH1A1MAPTTDP1KDM4ETSHR | |
| SCHEMBL31413507 | 0.73 | CYP1A2 (0.38) | CYP1A2ALDH1A1MAPTTDP1KMT2A | |
| SCHEMBL7524966 | 0.73 | CYP1A2 (0.38) | CYP1A2ALDH1A1MAPTTDP1KMT2A | |
| SCHEMBL11324222 | 0.73 | ALDH1A1 (0.51) | CYP1A2ALDH1A1MAPTTDP1KMT2A | |
| SCHEMBL11321842 | 0.72 | CYP1A2 (0.40) | CYP1A2ALDH1A1MAPTTDP1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0630883-B1 | Novel process to prepare N-alkyl-3,4-dialkyl-2,6-dinitroanilines | AGAN CHEMICAL MANUFACTURERS (IL) | 1998-09-16 | — | — | EP | disclosed |
| US-5602283-A | Multi-stage process for preparing N-alkyl-3,4-dialkyl-2,6-dinitroanilines | AGAN CHEMICAL MANUFACTURERS LTD. (IL) | 1997-02-11 | — | — | US | disclosed |
| US-5475148-A | Process and intermediate to prepare N-alkyl-3,4-dialkyl-2,6-dinitro-anilines | AGAN CHEMICAL MANUFACTURERS LTD. (IL) | 1995-12-12 | — | — | US | disclosed |
| EP-0630883-A1 | Novel process to prepare N-alkyl-3,4-dialkyl-2,6-dinitroanilines | AGAN CHEMICAL MANUFACTURERS LTD. (IL) | 1994-12-28 | — | — | EP | disclosed |