Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL628100 | 0.80 | MAPT (0.54) | ALDH1A1SMN1; SMN2LMNANPSR1POLB | |
| SCHEMBL624633 | 0.77 | PIK3CA (0.47) | ALDH1A1SMN1; SMN2LMNAKDM4EMAPT | |
| SCHEMBL623998 | 0.77 | PIM1 (0.51) | ALDH1A1KMT2AMEN1MAPK1KDM4E | |
| SCHEMBL627054 | 0.75 | KDM4E (0.48) | SMN1; SMN2LMNAKMT2AMEN1POLB | |
| SCHEMBL23288616 | 0.71 | KCNH2 (0.45) | ALDH1A1LMNAPOLBMAPTTP53 | |
| SCHEMBL22061402 | 0.71 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL30277649 | 0.71 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL20200909 | 0.71 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2KMT2AMEN1NPSR1 | |
| SCHEMBL20200911 | 0.71 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2KMT2AMEN1NPSR1 | |
| SCHEMBL624634 | 0.71 | MAPT (0.52) | LMNAPOLBMAPTTP53THRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012020217-A1 | AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) | 2012-02-16 | — | — | WO | disclosed |
| WO-2012020215-A1 | AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) | 2012-02-16 | — | — | WO | disclosed |