Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10353456 | 0.86 | EGFR (0.58) | ALDH1A1HSD17B10TSHREGFRHDAC1 | |
| SCHEMBL11846340 | 0.81 | HTT (0.50) | ALDH1A1HSD17B10TSHRHDAC1NPC1 | |
| SCHEMBL9850638 | 0.81 | CHRM2 (0.51) | ALDH1A1EGFRHDAC1NPC1MAPT | |
| SCHEMBL9859087 | 0.79 | EGFR (0.50) | ALDH1A1EGFRHDAC1NPC1MAPT | |
| SCHEMBL10384775 | 0.79 | EGFR (0.50) | ALDH1A1EGFRHDAC1NPC1MAPT | |
| SCHEMBL9850647 | 0.79 | EGFR (0.50) | ALDH1A1EGFRHDAC1NPC1MAPT | |
| SCHEMBL6726553 | 0.79 | NPC1 (0.64) | ALDH1A1HSD17B10EGFRHDAC1NPC1 | |
| SCHEMBL9683311 | 0.79 | NPC1 (0.64) | ALDH1A1HSD17B10EGFRHDAC1NPC1 | |
| SCHEMBL17886706 | 0.78 | HDAC4 (0.54) | ALDH1A1HDAC1NPC1MAPTRAB9A | |
| Hydrochloric Acid SCHEMBL9324495 | 0.77 | MAPT (0.67) | ALDH1A1HSD17B10EGFRHDAC1NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0097822-B1 | AMINOMETHYLDIOXOLANES AS PARASITICIDES | BAYER AG (DE) | 1987-07-15 | — | — | EP | disclosed |
| US-4668700-A | AMINO KETALS, FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1987-05-26 | — | — | US | disclosed |
| US-4503059-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1985-03-05 | — | — | US | disclosed |
| EP-0097822-A1 | Aminomethyldioxolanes as parasiticides | BAYER AG (DE) | 1984-01-11 | — | — | EP | disclosed |