Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | APOBEC3A | P31941 | 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 | |
|---|---|---|---|---|
| SCHEMBL4626490 | 0.89 | CYP2A6 (0.39) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL4625538 | 0.89 | KDM4E (0.45) | ALDH1A1KDM4ECYP1A1KMT2AMAPT | |
| SCHEMBL6848520 | 0.81 | POLB (0.41) | ALDH1A1KDM4ECYP1A1KMT2AMAPT | |
| Nitric Acid SCHEMBL8345678 | 0.81 | MAPK1 (0.45) | ALDH1A1KDM4ECYP1A1KMT2AMAPT | |
| SCHEMBL6843072 | 0.81 | CYP2A6 (0.32) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL97268 | 0.77 | ALDH1A1 (0.62) | ALDH1A1KDM4EKMT2AMAPTSMN1; SMN2 | |
| SCHEMBL6848030 | 0.75 | ALDH1A1 (0.33) | ALDH1A1KDM4E | |
| SCHEMBL6843056 | 0.75 | USP2 (0.38) | ALDH1A1KDM4ECYP1A1KMT2AMAPT | |
| SCHEMBL4626526 | 0.74 | HPGD (0.54) | ALDH1A1KMT2AMAPTATMSMN1; SMN2 | |
| SCHEMBL4626949 | 0.73 | CYP2A6 (0.43) | ALDH1A1KDM4ESMN1; SMN2 |
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-1300133-A2 | Agent for dyeing keratinous fibres | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-04-09 | — | — | EP | claimed |
| EP-1300133-A2 | Agent for dyeing keratinous fibres | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-04-09 | — | — | EP | disclosed |