Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | SNCA | P37840 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28695929 | 0.86 | HSD17B10 (0.58) | HSD17B10LMNASMN1; SMN2VCAM1ALDH1A1 | |
| SCHEMBL24475959 | 0.81 | ERN1 (0.43) | ALDH1A1MEN1KMT2ASNCAMAPT | |
| SCHEMBL22690672 | 0.80 | ALDH1A1 (0.48) | SMN1; SMN2ALDH1A1MEN1KMT2ASNCA | |
| SCHEMBL863170 | 0.77 | HSD17B10 (0.55) | HSD17B10LMNASMN1; SMN2VCAM1ALDH1A1 | |
| SCHEMBL26343383 | 0.77 | FFAR4 (0.52) | HSD17B10LMNASMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL9683830 | 0.77 | HSD17B10 (0.47) | HSD17B10LMNASMN1; SMN2VCAM1ALDH1A1 | |
| SCHEMBL22690549 | 0.77 | ALDH1A1 (0.43) | LMNASMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL6141028 | 0.75 | IDO1 (0.56) | ALDH1A1MAPTPOLBCYP2C19 | |
| SCHEMBL9683754 | 0.75 | HSD17B10 (0.45) | HSD17B10LMNASMN1; SMN2VCAM1ALDH1A1 | |
| SCHEMBL14157393 | 0.74 | MAPT (0.54) | HSD17B10LMNASMN1; SMN2ALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017198588-A1 | CAPSULES COMPRISING BENZYLPROPARGYLETHERS FOR USE AS NITRIFICATION INHIBITORS | BASF SE (DE) | 2017-11-23 | — | — | WO | disclosed |
| WO-2016075289-A1 | BENZYLPROPARGYLETHER AS NITRIFICATION INHIBITORS | BASF SE (DE) | 2016-05-19 | — | — | WO | disclosed |