Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | G6PD | P11413 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9509602 | 1.00 | MAPT (0.59) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9724840 | 0.86 | CYP11B2 (0.65) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9724843 | 0.86 | CYP11B2 (0.65) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9509587 | 0.81 | EPHX2 (0.45) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9509584 | 0.81 | EPHX2 (0.45) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9507434 | 0.79 | NPC1 (0.48) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9507430 | 0.79 | NPC1 (0.48) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9511041 | 0.78 | MAPT (0.49) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL9511034 | 0.78 | MAPT (0.49) | MAPTKDM4ECYP11B2CYP19A1RAB9A | |
| SCHEMBL5420129 | 0.78 | MAPT (0.58) | MAPTKDM4ECYP11B2CYP19A1RAB9A |
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-0298380-B1 | PROCESS FOR THE PREPARATION OF ALPHA-BETA-SUBSTITUTED ACROLEINS | BASF Aktiengesellschaft (DE) | 1993-09-29 | — | — | EP | disclosed |
| US-4920232-A | CHEMICAL INTERMEDIATES | BASF AKTIENGESELLSCHAFT (DE) | 1990-04-24 | — | — | US | disclosed |
| EP-0298380-A2 | Process for the preparation of alpha-beta-substituted acroleins | BASF Aktiengesellschaft (DE) | 1989-01-11 | — | — | EP | disclosed |