Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30933439 | 1.00 | ALDH1A1 (0.36) | ALDH1A1POLBMCOLN3KMT2AMEN1 | |
| SCHEMBL23355443 | 0.92 | KMT2A (0.38) | ALDH1A1POLBKMT2ANPC1RAB9A | |
| SCHEMBL29273417 | 0.88 | NOTUM (0.36) | KMT2AMEN1LMNA | |
| SCHEMBL23355434 | 0.81 | GAA (0.46) | ALDH1A1KMT2AMEN1KDM4EHPGD | |
| SCHEMBL29273410 | 0.79 | ALDH1A1 (0.37) | ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL24251609 | 0.77 | KMT2A (0.37) | ALDH1A1POLBKMT2ANPC1RAB9A | |
| SCHEMBL23355480 | 0.77 | KMT2A (0.37) | ALDH1A1KMT2ANPC1RAB9AKDM4E | |
| SCHEMBL23355473 | 0.76 | KMT2A (0.36) | ALDH1A1POLBKMT2ANPC1RAB9A | |
| SCHEMBL23355447 | 0.76 | MAPK14 (0.43) | ALDH1A1POLBKMT2AMEN1KDM4E | |
| SCHEMBL30933433 | 0.76 | MAPK14 (0.43) | ALDH1A1POLBKMT2AMEN1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-112996788-B | Anthelmintic heterocyclic compounds | 勃林格殷格翰动物保健美国公司 | 2024-07-16 | — | — | CN | disclosed |
| CN-112996788-A | Anthelmintic heterocyclic compounds | 勃林格殷格翰动物保健美国公司 | 2021-06-18 | — | — | CN | disclosed |
| EP-3820870-A1 | ANTHELMINTHIC HETEROCYCLIC COMPOUNDS | Boehringer Ingelheim Animal Health USA Inc. (US) | 2021-05-19 | — | — | EP | disclosed |