Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL11171493 | 0.77 | KDM4E (0.50) | KMT2ARAB9APOLBHTR7MAPT | |
| SCHEMBL11064700 | 0.77 | RCE1 (0.39) | KMT2ARAB9APOLBMAPTALDH1A1 | |
| SCHEMBL7787695 | 0.76 | KMT2A (0.52) | KMT2ARAB9APOLBHTR7MAPT | |
| SCHEMBL14741874 | 0.75 | USP2 (0.43) | ALDH1A1CYP1A2 | |
| SCHEMBL15657235 | 0.71 | CYP1A2 (0.65) | ALDH1A1CYP1A2 | |
| SCHEMBL3329139 | 0.71 | CYP1A2 (0.65) | ALDH1A1CYP1A2 | |
| SCHEMBL15658647 | 0.71 | CYP1A2 (0.65) | ALDH1A1CYP1A2 | |
| SCHEMBL15659978 | 0.71 | CYP1A2 (0.65) | ALDH1A1CYP1A2 | |
| SCHEMBL1171612 | 0.71 | CYP1A2 (0.65) | ALDH1A1CYP1A2 | |
| SCHEMBL6118706 | 0.71 | CYP1A2 (0.65) | ALDH1A1CYP1A2 |
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-4454351-A | Lactonic derivatives and use of same as starting materials for the preparation of macrocyclic hydroxyketones | FIRMENICH SA (CH) | 1984-06-12 | — | — | US | disclosed |
| US-4431827-A | Pentadecanolide derivatives | FIRMENICH S.A. (CH) | 1984-02-14 | — | — | US | disclosed |