Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 1.00 |
| ▸ | MAPT | P10636 | 3/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.77 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.77 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.57 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.57 |
| ▸ | CDK4 | P11802 | 1/20 | 0.54 |
| ▸ | CCND1 | P24385 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.51 |
| ▸ | PLG | P00747 | 1/20 | 0.51 |
| ▸ | PLAU | P00749 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL671759 | 1.00 | ALDH1A1 (1.00) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL1093746 | 0.87 | ALDH1A1 (1.00) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL13152910 | 0.83 | MAPT (0.71) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL13548412 | 0.83 | ALDH1A1 (0.70) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL29957546 | 0.83 | ALDH1A1 (0.70) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL15323127 | 0.80 | MAPT (0.64) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL29957922 | 0.80 | ALDH1A1 (0.66) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL2539684 | 0.80 | ALDH1A1 (0.66) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL11097545 | 0.80 | ALDH1A1 (0.80) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 | |
| SCHEMBL2537557 | 0.80 | ALDH1A1 (0.66) | ALDH1A1MAPTKDM4ECYP1A2CYP2C19 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |