Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 1.00 |
| ▸ | CYP1A1 | P04798 | 7/20 | 0.75 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.75 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.75 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.75 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 4/20 | 0.67 |
| ▸ | MAOB | P27338 | 1/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | PKM | P14618 | 1/20 | 0.67 |
| ▸ | APP | P05067 | 1/20 | 0.66 |
| ▸ | GSK3B | P49841 | 1/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.63 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL2705060 | 1.00 | MAPT (1.00) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL1604142 | 0.86 | CYP1A1 (0.77) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL31436361 | 0.86 | CYP1A1 (0.77) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL1322027 | 0.86 | CYP1A1 (0.82) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL31436369 | 0.86 | CYP1A1 (0.77) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL1322029 | 0.86 | CYP1A1 (0.82) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL979408 | 0.86 | CYP1B1 (1.00) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL20570877 | 0.86 | CYP1A1 (0.82) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL9503680 | 0.86 | CYP1B1 (1.00) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL3024151 | 0.85 | CYP1B1 (0.75) | MAPTCYP1A1CYP1A2CYP1B1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2167058-B1 | FAMILY OF PFKFB3 INHIBITORS WITH ANTI-NEOPLASTIC ACTIVITIES | UNIV LOUISVILLE RES FOUND (US) | 2015-08-12 | — | — | EP | disclosed |
| EP-0214566-B1 | 3-PROPENYL PYRIDINES AND THEIR USE AS FUNGICIDES | BASF Aktiengesellschaft (DE) | 1991-03-13 | — | — | EP | disclosed |
| EP-0214566-A2 | 3-Propenyl pyridines and their use as fungicides | BASF Aktiengesellschaft (DE) | 1987-03-18 | — | — | EP | disclosed |