Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | THPO | P40225 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 6/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
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 SCHEMBL4784533 | 0.98 | TDP1 (0.47) | TDP1TAAR1ALDH1A1CYP2C9HIF1A | |
| SCHEMBL15787294 | 0.83 | ALDH1A1 (0.43) | TDP1ALDH1A1CYP2C9SMN1; SMN2LMNA | |
| SCHEMBL15787619 | 0.83 | ALDH1A1 (0.43) | TDP1ALDH1A1CYP2C9SMN1; SMN2LMNA | |
| SCHEMBL4538533 | 0.81 | SLC6A4 (0.42) | TDP1TAAR1HIF1AKDM4ESMN1; SMN2 | |
| SCHEMBL6646740 | 0.81 | TRPA1 (0.41) | TAAR1 | |
| SCHEMBL1978925 | 0.81 | CYP1A2 (0.42) | TAAR1ALDH1A1SMN1; SMN2CYP1A2SLC6A2 | |
| SCHEMBL6631545 | 0.81 | ALDH1A1 (0.36) | ALDH1A1ESR1ESR2TSHR | |
| SCHEMBL1964723 | 0.80 | ALDH1A1 (0.55) | TAAR1ALDH1A1CYP2C9THPOALOX15 | |
| SCHEMBL1964722 | 0.80 | ALDH1A1 (0.55) | TAAR1ALDH1A1CYP2C9THPOALOX15 | |
| SCHEMBL4110424 | 0.80 | ALDH1A1 (0.55) | TAAR1ALDH1A1CYP2C9THPOALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007071683-A1 | COMPOSITION FOR DYEING KERATIN FIBRES WITH A TETRAAZAPENTAMETHINE CATIONIC DIRECT DYE AND A NONIONIC SURFACTANT | L'ORÉAL (FR) | 2007-06-28 | — | — | WO | disclosed |
| WO-2004005407-A2 | TETRA-AZAPENTAMETHINE AND USE THEREOF FOR DYEING KERATINOUS FIBERS | L'OREAL (FR) | 2004-01-15 | — | — | WO | disclosed |