Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 SCHEMBL11313451 | 0.99 | KDM4E (0.45) | CYP2D6TSHRHIF1APOLBKDM4E | |
| SCHEMBL11324568 | 0.82 | CYP2D6 (0.44) | CYP2D6TSHRHIF1APOLBKDM4E | |
| Hydrochloric Acid SCHEMBL9329071 | 0.81 | KDM4E (0.45) | CYP2D6TSHRHIF1APOLBKDM4E | |
| Hydrochloric Acid SCHEMBL6548906 | 0.76 | KMT2A (0.41) | CYP2D6TSHRHIF1APOLBKDM4E | |
| SCHEMBL11471985 | 0.75 | LMNA (0.41) | CYP2D6TSHRPOLBKDM4EMEN1 | |
| SCHEMBL9329328 | 0.75 | CYP2D6 (0.45) | CYP2D6TSHRHIF1APOLBKDM4E | |
| Hydrochloric Acid SCHEMBL11314654 | 0.74 | LMNA (0.40) | CYP2D6TSHRPOLBKDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL11315151 | 0.72 | CYP2A13 (0.41) | CYP2D6TSHRHIF1AKDM4EALDH1A1 | |
| SCHEMBL5967992 | 0.70 | TSHR (0.59) | CYP2D6TSHRHIF1APOLBKDM4E | |
| SCHEMBL11332969 | 0.70 | LMNA (0.46) | CYP2D6TSHRPOLBMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4187220-A | New O-(3-amino-2-hydroxy-propyl)-amidoxime derivatives, process for the preparation thereof and pharmaceutical compositions containing same | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) | 1980-02-05 | — | — | US | claimed |