Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MDM4 | O15151 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8174616 | 0.82 | FGFR1 (0.41) | NPSR1CCNE1CDK2CDK5KDM4E | |
| SCHEMBL8201301 | 0.72 | FGFR1 (0.46) | NPSR1CCNE1CDK2CDK5KDM4E | |
| SCHEMBL29919591 | 0.69 | L3MBTL1 (0.48) | CCNE1CDK2CDK5TSHRADORA2A | |
| SCHEMBL28936065 | 0.69 | L3MBTL1 (0.48) | CCNE1CDK2CDK5TSHRADORA2A | |
| SCHEMBL9564884 | 0.69 | HDAC1 (0.47) | KDM4ETSHRTP53ALDH1A1KMT2A | |
| SCHEMBL14495342 | 0.68 | GRIN2D (0.44) | KDM4ECA12CA1CA2CA9 | |
| SCHEMBL10970822 | 0.67 | MAP4K4 (0.58) | KDM4EALDH1A1LMNAKMT2AMEN1 | |
| SCHEMBL12545778 | 0.67 | MAP4K4 (0.49) | NPSR1KDM4ETSHRTP53ALDH1A1 | |
| SCHEMBL22715486 | 0.67 | KCNMA1 (0.42) | KDM4ETP53ALDH1A1KMT2AHSD17B10 | |
| SCHEMBL10995388 | 0.67 | ADORA1 (0.42) | CCNE1CDK2CDK5CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6057445-A | FORMATION OF CARBON NITROGEN BOND, CYCLIZATION AND HALOGENATION | EURO-CELTIQUE S.A. (LU) | 2000-05-02 | — | — | US | disclosed |
| WO-1999031104-A1 | PREPARATION OF 3-SUBSTITUTED ADENINES AND IMIDAZO PYRIDINES | EURO-CELTIQUE, S.A. (LU) | 1999-06-24 | — | — | WO | disclosed |