Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | AGXT | P21549 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 2/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3161372 | 0.86 | AGXT (0.64) | KCNH2AGXTNPC1SMN1; SMN2RAB9A | |
| SCHEMBL9617939 | 0.86 | AGXT (0.64) | KCNH2AGXTNPC1SMN1; SMN2RAB9A | |
| SCHEMBL492258 | 0.86 | TSHR (0.52) | KMT2ALMNAALDH1A1TSHRCYP3A4 | |
| Lithium SCHEMBL585057 | 0.84 | AGXT (0.61) | KCNH2AGXTNPC1SMN1; SMN2RAB9A | |
| Potassium SCHEMBL586332 | 0.84 | AGXT (0.61) | KCNH2AGXTNPC1SMN1; SMN2RAB9A | |
| SCHEMBL586154 | 0.84 | AGXT (0.61) | KCNH2AGXTNPC1SMN1; SMN2RAB9A | |
| Hydrochloric Acid SCHEMBL27794104 | 0.84 | TSHR (0.50) | KMT2ALMNAALDH1A1TSHRCYP3A4 | |
| SCHEMBL22537715 | 0.83 | RAB9A (0.46) | KCNH2NPC1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL8361590 | 0.79 | NPC1 (0.58) | KCNH2NPC1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL171160 | 0.79 | CYP17A1 (0.54) | NPC1KMT2ASMN1; SMN2RAB9AHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3515912-B1 | COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES | CENTRE NAT RECH SCIENT (FR) | 2020-10-14 | — | — | EP | disclosed |
| WO-2018055316-A1 | COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2018-03-29 | — | — | WO | disclosed |