Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP7 | P09237 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | ECE1 | P42892 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27031032 | 0.96 | CYP2D6 (0.41) | CYP2D6ALDH1A1POLBMMP1MMP7 | |
| SCHEMBL15577087 | 0.84 | CYP2D6 (0.49) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL28827152 | 0.81 | CYP2D6 (0.44) | CYP2D6ALDH1A1MMP1MMP7MMP12 | |
| SCHEMBL486885 | 0.79 | CYP2D6 (0.40) | CYP2D6CA1CA2CA4KMT2A | |
| SCHEMBL1238048 | 0.77 | CYP2D6 (0.44) | CYP2D6MMP1MMP7MMP12ECE1 | |
| SCHEMBL10706581 | 0.77 | GPR84 (0.40) | CA2GPR84PTGER2 | |
| SCHEMBL11880132 | 0.77 | ALDH1A1 (0.56) | ALDH1A1MMP1MMP7MMP12ECE1 | |
| SCHEMBL23501350 | 0.75 | ALDH1A1 (0.59) | ALDH1A1MMP1MMP7MMP12ECE1 | |
| SCHEMBL8900713 | 0.75 | CYP2D6 (0.49) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL11860786 | 0.73 | CYP1A2 (0.38) | CYP2D6ALDH1A1PTGER2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5670661-A | Process for producing lactones and lactones obtained with this process | INDUSTRIE CHIMICHE CAFFARO S.P.A. (IT) | 1997-09-23 | — | — | US | disclosed |
| EP-0703912-A1 | PROCESS FOR PRODUCING LACTONES AND LACTONES OBTAINED WITH THIS PROCESS | INDUSTRIE CHIMICHE CAFFARO S.p.A. (IT) | 1996-04-03 | — | — | EP | disclosed |
| WO-1994029294-A1 | PROCESS FOR PRODUCING LACTONES AND LACTONES OBTAINED WITH THIS PROCESS | INDUSTRIE CHIMICHE CAFFARO S.P.A (IT) | 1994-12-22 | — | — | WO | disclosed |