Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | G6PD | P11413 | 1/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.43 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9697546 | 0.95 | CNR1 (0.48) | G6PDHCRTR1IDO1HKDC1USP2 | |
| SCHEMBL10606889 | 0.82 | CYP1A2 (0.44) | CYP1A2CYP2C9CYP2C19NCEH1CNR1 | |
| Acetic Acid SCHEMBL11586218 | 0.81 | G6PD (0.55) | G6PDHCRTR1HKDC1CYP1A2CYP2C9 | |
| SCHEMBL27511461 | 0.80 | SLC2A1 (0.48) | CYP1A2CYP2C9CYP2C19KMT2ANPSR1 | |
| SCHEMBL10343357 | 0.79 | CNR1 (0.45) | CYP1A2CYP2C19HSD17B10MEN1KMT2A | |
| SCHEMBL15766002 | 0.78 | ACP1 (0.49) | ALDH1A1POLBMAPTACP1 | |
| SCHEMBL10614728 | 0.77 | CNR1 (0.52) | IDO1CYP1A2CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL28039128 | 0.76 | SLC2A1 (0.47) | CYP1A2CYP2C19HSD17B10MEN1KMT2A | |
| SCHEMBL28038825 | 0.76 | SLC2A1 (0.47) | CYP1A2CYP2C19HSD17B10MEN1KMT2A | |
| SCHEMBL28039189 | 0.76 | SLC2A1 (0.47) | CYP1A2CYP2C19HSD17B10MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0255643-A2 | Metal complex compound useful as a near infrared absorber | HODOGAYA CHEMICAL CO., LTD. (JP) | 1988-02-10 | — | — | EP | disclosed |