Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP2 | P42575 | 1/20 | 0.43 |
| ▸ | CASP4 | P49662 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | CASP9 | P55211 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.43 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.42 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5378500 | 0.80 | CASP3 (0.43) | CASP3CASP1CASP2CASP4CASP7 | |
| SCHEMBL7106481 | 0.80 | KAT2B (0.56) | CARM1PRMT6KAT2BCHRNB2CHRNA5 | |
| SCHEMBL4443892 | 0.80 | KAT2B (0.56) | CARM1PRMT6KAT2BCHRNB2CHRNA5 | |
| SCHEMBL13162978 | 0.80 | KAT2B (0.56) | CARM1PRMT6KAT2BCHRNB2CHRNA5 | |
| SCHEMBL4150800 | 0.76 | CASP3 (0.43) | CASP3CASP1CASP2CASP4CASP7 | |
| SCHEMBL4150796 | 0.76 | CTSL (0.48) | CASP3CASP1CASP2CASP4CASP7 | |
| SCHEMBL14626061 | 0.75 | RAB9A (0.51) | CARM1PRMT6KMT2AACHERAB9A | |
| SCHEMBL14591100 | 0.74 | RAB9A (0.47) | CASP3CASP1CASP2CASP4CASP7 | |
| SCHEMBL27304337 | 0.69 | HSD11B1 (0.45) | CARM1PRMT6DPP4 | |
| SCHEMBL9679337 | 0.69 | EPHX1 (0.54) | CARM1PRMT6MEN1KMT2AACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-3016939-B1 | FORMATION OF CHIRAL 4-CHROMANONES USING CHIRAL PYRROLIDINES IN THE PRESENCE OF ACIDS | DSM IP ASSETS BV (NL) | 2017-03-29 | — | — | EP | disclosed |