Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 6/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | PRMT3 | O60678 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTR1E | P28566 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6256908 | 0.89 | EPHX1 (0.48) | EPHX1KDM4ERAB9AEPHX2 | |
| SCHEMBL6262774 | 0.87 | PIN1 (0.47) | EPHX1KMT2ARAB9APIN1 | |
| SCHEMBL6256917 | 0.81 | GAA (0.41) | CA2CA12CA1CA9LMNA | |
| SCHEMBL6261901 | 0.81 | HPGD (0.42) | EPHX1CA2LMNANPC1RAB9A | |
| SCHEMBL6258385 | 0.80 | EPHX1 (0.55) | EPHX1CA2CA12CA1CA9 | |
| SCHEMBL6263050 | 0.80 | PIN1 (0.42) | CA2LMNANPC1RAB9APIN1 | |
| SCHEMBL6262593 | 0.79 | EPHX1 (0.44) | EPHX1CA2CA12CA1CA9 | |
| SCHEMBL6260999 | 0.78 | EPHX2 (0.40) | MEN1KMT2ANPC1RAB9APIN1 | |
| SCHEMBL6261077 | 0.76 | SMN1; SMN2 (0.40) | LMNAMEN1KMT2AKDM4ERAB9A | |
| SCHEMBL6257454 | 0.75 | MMP1 (0.33) | CA2CA12CA1CA9S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005080406-A2 | COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF | JERINI AG (DE) | 2005-09-01 | — | — | WO | claimed |