Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.34 |
| ▸ | HPGD | P15428 | 5/20 | 0.34 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10521464 | 0.84 | ALDH1A1 (0.33) | ALDH1A1HSD17B10KDM4EHPGDCFTR | |
| SCHEMBL23313200 | 0.79 | ALDH1A1 (0.51) | ALDH1A1HSD17B10KDM4EHPGDCFTR | |
| Aniline SCHEMBL10519460 | 0.69 | NOS3 (0.39) | ALDH1A1HSD17B10HPGDNPC1RAB9A | |
| Bicarbonate SCHEMBL11817835 | 0.69 | HPGD (0.34) | KDM4EHPGDRAB9AKMT2APOLB | |
| SCHEMBL10520106 | 0.67 | L3MBTL1 (0.46) | ALDH1A1KDM4ENPC1RAB9AKMT2A | |
| SCHEMBL6396744 | 0.67 | — | — | |
| SCHEMBL23313034 | 0.66 | KDM4E (0.47) | ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL10520103 | 0.65 | NOS3 (0.36) | ALDH1A1MAPT | |
| SCHEMBL6153221 | 0.65 | RIPK1 (0.51) | ALDH1A1KDM4EHPGDNPC1RAB9A | |
| SCHEMBL20349882 | 0.64 | RIPK1 (0.43) | ALDH1A1KDM4EKMT2ASMN1; SMN2TP53 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4797146-A | INSECTICIDES, FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-01-10 | — | — | US | claimed |