Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.52 |
| ▸ | MAPT | P10636 | 8/20 | 0.52 |
| ▸ | MEN1 | O00255 | 7/20 | 0.52 |
| ▸ | RAB9A | P51151 | 6/20 | 0.52 |
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TTR | P02766 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3668804 | 0.82 | CNR1 (0.61) | KMT2AMAPTMEN1RAB9ANPC1 | |
| SCHEMBL29776946 | 0.81 | CA12 (0.70) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL4342381 | 0.81 | KMT2A (0.68) | KMT2AMAPTMEN1RAB9ANPC1 | |
| SCHEMBL34420050 | 0.81 | CA12 (0.64) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL3787717 | 0.80 | CXCR2 (0.66) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL4343434 | 0.79 | DDX3X (0.65) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL3681281 | 0.79 | MGLL (0.73) | KMT2AMAPTMEN1RAB9ANPC1 | |
| SCHEMBL5595432 | 0.79 | RET (0.56) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL6567241 | 0.78 | EPHX1 (0.59) | CA2CA9KMT2AMAPTMEN1 | |
| SCHEMBL4345909 | 0.77 | KDM4E (0.66) | KMT2AMAPTMEN1RAB9ANPC1 |
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 |