Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.58 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.58 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.48 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18059810 | 1.00 | CYP11B1 (0.58) | CYP11B1CYP11B2TBXAS1G6PC1LTA4H | |
| Piperazine SCHEMBL28139495 | 0.91 | CYP11B1 (0.49) | CYP11B1CYP11B2TBXAS1G6PC1LTA4H | |
| SCHEMBL24384517 | 0.81 | CYP11B1 (0.57) | CYP11B1CYP11B2TBXAS1CYP2D6CYP1A2 | |
| SCHEMBL9584872 | 0.81 | CYP11B2 (0.52) | CYP11B1CYP11B2G6PC1LTA4HCYP2D6 | |
| SCHEMBL6960280 | 0.81 | CYP3A4 (0.52) | CYP11B1CYP11B2TBXAS1CYP2D6CYP1A2 | |
| SCHEMBL6958821 | 0.81 | CYP3A4 (0.52) | CYP11B1CYP11B2TBXAS1CYP2D6CYP1A2 | |
| SCHEMBL6958816 | 0.81 | CYP3A4 (0.52) | CYP11B1CYP11B2TBXAS1CYP2D6CYP1A2 | |
| SCHEMBL4256257 | 0.80 | MAOB (0.67) | LTA4HCYP3A4MEN1ALOX15KMT2A | |
| SCHEMBL163963 | 0.80 | MAOB (0.67) | LTA4HCYP3A4MEN1ALOX15KMT2A | |
| SCHEMBL1892917 | 0.80 | MAOB (0.67) | LTA4HCYP3A4MEN1ALOX15KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016146689-A1 | ORGANOZINC REAGENTS AND PROCESSES FOR PREPARING AND USING THE SAME | LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) | 2016-09-22 | — | — | WO | disclosed |
| EP-3070083-A1 | Organozinc reagents and processes for preparing and using the same | Ludwig-Maximilians-Universität München (DE) | 2016-09-21 | — | — | EP | disclosed |
| EP-3070083-A1 | Organozinc reagents and processes for preparing and using the same | Ludwig-Maximilians-Universität München (DE) | 2016-09-21 | — | — | EP | disclosed |