Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.33 |
| ▸ | STK16 | O75716 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | DMPK | Q09013 | 1/20 | 0.33 |
| ▸ | MAP2K5 | Q13163 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL108260 | 0.83 | ALDH1A1 (0.42) | ALDH1A1KDM4ETSHRTDP1GLA | |
| SCHEMBL6261612 | 0.82 | TP53 (0.39) | ALDH1A1KDM4ETSHRTDP1GLA | |
| SCHEMBL3115134 | 0.75 | KDM4E (0.40) | ALDH1A1KDM4ETSHRGLABMPR1B | |
| SCHEMBL4637282 | 0.75 | ALDH1A1 (0.51) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| SCHEMBL109784 | 0.73 | ALDH1A1 (0.47) | ALDH1A1KDM4EGLACYP2C19HPGD | |
| SCHEMBL15058572 | 0.72 | ALDH1A1 (0.38) | ALDH1A1KDM4ETSHRTDP1GLA | |
| SCHEMBL5550162 | 0.70 | ALDH1A1 (0.36) | ALDH1A1KDM4ETSHRTDP1GLA | |
| SCHEMBL9360724 | 0.70 | ALDH1A1 (0.46) | ALDH1A1KDM4ETSHRTDP1GLA | |
| SCHEMBL15933187 | 0.69 | TSHR (0.42) | ALDH1A1KDM4ETSHRTDP1GLA | |
| SCHEMBL15058573 | 0.68 | CTSL (0.31) | ALDH1A1BMPR1BSTK16ABL1FLT3 |
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-1585488-A1 | NOVEL PHENYLENEDIAMINE DERIVATIVE COUPLING CONSTITUENTS | Henkel Kommanditgesellschaft auf Aktien (DE) | 2005-10-19 | — | — | EP | claimed |
| WO-2004058206-A1 | NOVEL PHENYLENEDIAMINE DERIVATIVE COUPLING CONSTITUENTS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2004-07-15 | — | — | WO | claimed |
| EP-1585488-A1 | NOVEL PHENYLENEDIAMINE DERIVATIVE COUPLING CONSTITUENTS | Henkel Kommanditgesellschaft auf Aktien (DE) | 2005-10-19 | — | — | EP | disclosed |
| WO-2004058206-A1 | NOVEL PHENYLENEDIAMINE DERIVATIVE COUPLING CONSTITUENTS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2004-07-15 | — | — | WO | disclosed |