Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Indene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | AURKA | O14965 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8459502 | 0.89 | KDM4E (0.36) | BRD4CA1CA2KDM4EALDH1A1 | |
| Indene SCHEMBL6627120 | 0.74 | CA1 (0.36) | BRD4CA1CA2KDM4EALDH1A1 | |
| Indene SCHEMBL6628425 | 0.74 | CA2 (0.36) | BRD4CA1CA2KDM4EALDH1A1 | |
| Indene SCHEMBL4305388 | 0.72 | CA1 (0.36) | BRD4CA1CA2KDM4EALDH1A1 | |
| Indene SCHEMBL6247868 | 0.72 | CA1 (0.36) | BRD4CA1CA2KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL9010289 | 0.69 | KDM4E (0.33) | BRD4KDM4EALDH1A1MAPTAURKA | |
| Indene SCHEMBL4452296 | 0.68 | NPC1 (0.33) | BRD4CA1CA2KDM4EALDH1A1 | |
| Anthracene SCHEMBL28057537 | 0.68 | CA1 (0.47) | CA1CA2ALDH1A1MAPTCYP2D6 | |
| Naphthalene SCHEMBL2783692 | 0.67 | CA1 (0.50) | CA1CA2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL9068093 | 0.67 | CYP11B2 (0.33) | CA1CA2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1567561-B1 | BIMETALLIC INDENOINDOLYL CATALYSTS | EQUISTAR CHEM LP (US) | 2009-05-27 | — | — | EP | disclosed |
| EP-1567561-A1 | BIMETALLIC INDENOINDOLYL CATALYSTS | Equistar Chemicals, LP (US) | 2005-08-31 | — | — | EP | disclosed |
| US-6841500-B2 | Bimetallic indenoindolyl catalysts | EQUISTAR CHEMICALS, LP (US) | 2005-01-11 | — | — | US | disclosed |
| WO-2004050718-A1 | BIMETALLIC INDENOINDOLYL CATALYSTS | EQUISTAR CHEMICALS, LP (US) | 2004-06-17 | — | — | WO | disclosed |
| US-20040106514-A1 | Bimetallic indenoindolyl catalysts | EQUISTAR CHEMICALS, LP | 2004-06-03 | — | — | US | disclosed |