Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SLC40A1 | Q9NP59 | 7/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | METAP2 | P50579 | 2/20 | 0.46 |
| ▸ | METAP1 | P53582 | 2/20 | 0.46 |
| ▸ | GLO1 | Q04760 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | G6PD | P11413 | 1/20 | 0.46 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.46 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL11132378 | 0.88 | LMNA (0.79) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| Phenanthroline SCHEMBL29101071 | 0.86 | SMN1; SMN2 (0.73) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| SCHEMBL28527433 | 0.83 | LMNA (0.89) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| Benzene SCHEMBL27538628 | 0.83 | LMNA (0.96) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| SCHEMBL8313 | 0.81 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| SCHEMBL6513577 | 0.81 | LMNA (1.00) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| Sulfuric Acid SCHEMBL3271974 | 0.80 | LMNA (0.77) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| Acetic Acid SCHEMBL9177085 | 0.80 | LMNA (0.77) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| Acetic Acid SCHEMBL7902877 | 0.80 | LMNA (0.77) | LMNASMN1; SMN2ALDH1A1HTTTDP1 | |
| Sulfuric Acid SCHEMBL7488838 | 0.80 | LMNA (0.77) | LMNASMN1; SMN2ALDH1A1HTTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116574055-A | 4- (8-hydroxy-5-quinolyl azo) benzenesulfonic acid phenanthroline dye eutectic and preparation method thereof | 吉林医药学院 | 2023-08-11 | — | — | CN | claimed |
| CN-116574055-A | 4- (8-hydroxy-5-quinolyl azo) benzenesulfonic acid phenanthroline dye eutectic and preparation method thereof | 吉林医药学院 | 2023-08-11 | — | — | CN | disclosed |
| CN-116574055-A | 4- (8-hydroxy-5-quinolyl azo) benzenesulfonic acid phenanthroline dye eutectic and preparation method thereof | 吉林医药学院 | 2023-08-11 | — | — | CN | disclosed |
| CN-116574055-A | 4- (8-hydroxy-5-quinolyl azo) benzenesulfonic acid phenanthroline dye eutectic and preparation method thereof | 吉林医药学院 | 2023-08-11 | — | — | CN | disclosed |