Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.59 |
| ▸ | RAB9A | P51151 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.59 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4349649 | 0.83 | KMT2A (0.61) | KDM4EKMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL22567818 | 0.82 | KDR (0.60) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL7759976 | 0.82 | MEN1 (0.68) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL6565658 | 0.80 | TRPV1 (0.66) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL4354644 | 0.79 | DDX3X (0.65) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL6567619 | 0.79 | KMT2A (0.65) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL4350139 | 0.78 | SMN1; SMN2 (0.63) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL24732382 | 0.77 | KDR (0.73) | RAB9AKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL4341621 | 0.77 | KDM4E (0.66) | NPC1RAB9AKDM4EMEN1KMT2A | |
| SCHEMBL4349655 | 0.77 | ALDH1A1 (0.43) | NPC1RAB9AKDM4EMEN1KMT2A |
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 |