Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14563318 | 0.85 | CYP2D6 (0.72) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL8900713 | 0.82 | CYP2D6 (0.49) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL14563400 | 0.82 | CYP2D6 (0.49) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL14563392 | 0.79 | CYP2D6 (0.39) | CYP2D6ALDH1A1ACE | |
| SCHEMBL10614246 | 0.78 | BRD4 (0.40) | CYP2D6TP53RAB9AHSD17B10MMP1 | |
| SCHEMBL9518399 | 0.76 | CYP2D6 (0.49) | CYP2D6ALDH1A1POLBKDM4EHSD17B10 | |
| SCHEMBL6977408 | 0.76 | ALDH1A1 (0.55) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL15577104 | 0.75 | CYP2D6 (0.44) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL87947 | 0.74 | CYP2D6 (0.50) | CYP2D6ALDH1A1POLBKDM4ENPC1 | |
| SCHEMBL28379100 | 0.74 | CYP2D6 (0.50) | CYP2D6ALDH1A1POLBKDM4ENPC1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070054837-A1 | Bicyclic lactones, perfumery uses thereof, processes for preparing same and intermediates therefor | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2007-03-08 | — | — | US | disclosed |
| US-20070054837-A1 | Bicyclic lactones, perfumery uses thereof, processes for preparing same and intermediates therefor | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2007-03-08 | — | — | US | disclosed |
| US-7169747-B2 | Bicyclic lactones, perfumery uses thereof, processes for preparing same and intermediates therefor | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2007-01-30 | — | — | US | disclosed |
| US-7169747-B2 | Bicyclic lactones, perfumery uses thereof, processes for preparing same and intermediates therefor | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2007-01-30 | — | — | US | disclosed |
| EP-0729498-A1 | CHIRAL NEMATIC LIQUID CRYSTALLINE COMPOSITIONS | THE UNIVERSITY OF ROCHESTER (US) | 1996-09-04 | — | — | EP | disclosed |
| EP-0729498-A4 | CHIRAL NEMATIC LIQUID CRYSTALLINE COMPOSITIONS | UNIV ROCHESTER (US) | 1996-07-16 | — | — | EP | disclosed |
| WO-1995014067-A1 | CHIRAL NEMATIC LIQUID CRYSTALLINE COMPOSITIONS | UNIVERSITY OF ROCHESTER (US) | 1995-05-26 | — | — | WO | disclosed |