Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Ciclopirox. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.90 |
| ▸ | LMNA | P02545 | 1/20 | 0.90 |
| ▸ | TP53 | P04637 | 1/20 | 0.90 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.90 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.90 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.90 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.90 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.90 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.90 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.72 |
| ▸ | KDM4B | O94953 | 1/20 | 0.72 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.72 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.72 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.72 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.72 |
| ▸ | IDH1 | O75874 | 7/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| Ciclopirox SCHEMBL66960 | 0.95 | KDM4E (1.00) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL1411724 | 0.95 | KDM4E (1.00) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL514700 | 0.95 | KDM4E (1.00) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL28169345 | 0.90 | KDM4E (0.90) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL30969895 | 0.85 | NR1I2 (0.94) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL34424 | 0.85 | NR1I2 (1.00) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL1818483 | 0.85 | NR1I2 (1.00) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL4886428 | 0.81 | KDM4E (0.72) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL21571455 | 0.80 | NR1I2 (0.83) | KDM4ELMNATP53CYP1A2ALOX12 | |
| Ciclopirox SCHEMBL27927647 | 0.79 | KDM4E (0.71) | KDM4ELMNATP53CYP1A2ALOX12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005092273-A2 | METHOD OF COMPATIBILIZING CATIONIC MATERIALS WITH ANIONIC POLYMERS | NOVEON IP HOLDINGS CORP. (US) | 2005-10-06 | — | — | WO | disclosed |
| EP-1534221-A1 | COMPOSITIONS OF ANIONIC POLYMERIC RHEOLOGY MODIFIERS AND CATIONIC MATERIALS | Noveon IP Holdings Corp. (US) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004026271-A1 | COMPOSITIONS OF ANIONIC POLYMERIC RHEOLOGY MODIFIERS AND CATIONIC MATERIALS | NOVEON IP HOLDINGS CORP. (US) | 2004-04-01 | — | — | WO | disclosed |