Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | IDH1 | O75874 | 1/20 | 0.52 |
| ▸ | VCAM1 | P19320 | 5/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.46 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.46 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11876010 | 0.85 | GAA (0.63) | GAASMN1; SMN2IDH1VCAM1PKM | |
| SCHEMBL10714707 | 0.83 | VCAM1 (0.45) | GAASMN1; SMN2VCAM1PKMMAPT | |
| SCHEMBL9749511 | 0.79 | FFAR4 (0.71) | GAASMN1; SMN2VCAM1PKMMEN1 | |
| SCHEMBL1530093 | 0.76 | VCAM1 (0.56) | GAAIDH1VCAM1MEN1KMT2A | |
| SCHEMBL14574910 | 0.76 | VCAM1 (0.53) | GAAIDH1VCAM1MEN1KMT2A | |
| SCHEMBL27809726 | 0.76 | VCAM1 (0.61) | GAAIDH1VCAM1PKMMEN1 | |
| SCHEMBL27176681 | 0.73 | SMN1; SMN2 (0.64) | GAASMN1; SMN2IDH1PKMMEN1 | |
| SCHEMBL7529685 | 0.73 | TP53 (0.61) | SMN1; SMN2MEN1KMT2AHTTL3MBTL1 | |
| SCHEMBL27183399 | 0.73 | VCAM1 (0.53) | GAAIDH1VCAM1MEN1KMT2A | |
| SCHEMBL10383134 | 0.73 | VCAM1 (0.61) | GAAIDH1VCAM1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5132461-A | Process for the production of 4-[ethyl-(2'-hydroxyethyl)-amino]-1-[(2'-hydroxyethyl)-amino]-2-nitro-benzene | WELLA AKTIENGESELLSCHAFT (DE) | 1992-07-21 | — | — | US | disclosed |
| US-4900869-A | Process for the production of 4-[ethyl-(2'-hydroxyethyl)-amino]-1-[(2'-hydroxyethyl)-amino]-2-nitrobenzene | Wella, Aktiengesellschaft (DE) | 1990-02-13 | — | — | US | disclosed |