Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.66 |
| ▸ | RAB9A | P51151 | 6/20 | 0.66 |
| ▸ | MAPT | P10636 | 6/20 | 0.66 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.56 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | CNR1 | P21554 | 1/20 | 0.55 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 7/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9547503 | 0.85 | RAB9A (0.89) | NPC1RAB9AMAPTGRIK1GRIK2 | |
| SCHEMBL11057371 | 0.82 | NPC1 (0.77) | NPC1RAB9AMAPTGRIK1GRIK2 | |
| SCHEMBL4342381 | 0.82 | KMT2A (0.68) | NPC1RAB9AMAPTCNR1EPHX1 | |
| SCHEMBL6567241 | 0.81 | EPHX1 (0.59) | NPC1RAB9AMAPTCA2EPHX1 | |
| SCHEMBL24272500 | 0.80 | MAPT (0.80) | NPC1RAB9AMAPTGRIK1GRIK2 | |
| SCHEMBL24272501 | 0.80 | MAPT (0.80) | NPC1RAB9AMAPTGRIK1GRIK2 | |
| SCHEMBL12846485 | 0.80 | DEGS1 (0.66) | NPC1RAB9AMAPTMEN1KMT2A | |
| SCHEMBL11049543 | 0.80 | MAPT (1.00) | NPC1RAB9AMAPTGRIK1GRIK2 | |
| SCHEMBL30697002 | 0.80 | MAPT (1.00) | NPC1RAB9AMAPTGRIK1GRIK2 | |
| SCHEMBL3668804 | 0.79 | CNR1 (0.61) | NPC1RAB9AMAPTGRIK1CNR1 |
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-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |