Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 3/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
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 SCHEMBL1395436 | 0.98 | KDM4E (0.41) | CYP2D6CYP2C19KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL11867934 | 0.87 | GABRA1 (0.38) | CYP2D6CYP2C19KDM4EALDH1A1HPGD | |
| SCHEMBL1038673 | 0.79 | KDM4E (0.41) | KDM4EACHEBCHE | |
| Bromide SCHEMBL14811730 | 0.78 | KDM4E (0.40) | KDM4ESMN1; SMN2NPC1RAB9AACHE | |
| Hydrochloric Acid SCHEMBL11725090 | 0.76 | KDM4E (0.45) | CYP2D6CYP2C19KDM4EALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL11692702 | 0.74 | TP53 (0.48) | CYP2D6CYP2C19KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL31304100 | 0.74 | HDAC8 (0.47) | CYP2D6CYP2C19KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL10730872 | 0.73 | TDP1 (0.48) | CYP2D6CYP2C19KDM4EALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL6892436 | 0.73 | HDAC8 (0.46) | CYP2D6CYP2C19KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL12558271 | 0.73 | CYP2D6 (0.46) | CYP2D6CYP2C19KDM4EALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110230049-A | A kind of novel non-chrome sealer | 浙江九合金属表面处理技术有限公司 | 2019-09-13 | — | — | CN | claimed |
| JP-2011241521-A | FLUORESCENCE INHIBITOR AND SUPPRESSING METHOD OF FLUORESCENCE | SENKA KK | 2011-12-01 | — | — | JP | disclosed |
| US-4071746-A | Alkylbenzyl pyridinium compounds and uses | PETROLITE CORPORATION (US) | 1978-01-31 | — | — | US | disclosed |
| US-4071746-A | Alkylbenzyl pyridinium compounds and uses | PETROLITE CORPORATION (US) | 1978-01-31 | — | — | US | disclosed |
| US-4071746-A | Alkylbenzyl pyridinium compounds and uses | PETROLITE CORPORATION (US) | 1978-01-31 | — | — | US | disclosed |