Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MPI | P34949 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PKLR | P30613 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23925034 | 0.85 | CYP2A13 (0.38) | ALDH1A1KMT2AKDM4EMEN1SMN1; SMN2 | |
| SCHEMBL23925319 | 0.82 | ALDH1A1 (0.43) | ALDH1A1KMT2AL3MBTL1MAPTKDM4E | |
| SCHEMBL5907586 | 0.81 | TAAR1 (0.50) | ALDH1A1KMT2AL3MBTL1MAPTKDM4E | |
| SCHEMBL5907582 | 0.79 | TAAR1 (0.48) | ALDH1A1KMT2AL3MBTL1RAB9ASMN1; SMN2 | |
| SCHEMBL30407583 | 0.76 | RAB9A (0.42) | ALDH1A1KMT2AL3MBTL1MAPTKDM4E | |
| SCHEMBL23064539 | 0.76 | ALDH1A1 (0.48) | ALDH1A1KMT2AL3MBTL1MAPTKDM4E | |
| SCHEMBL30667343 | 0.72 | KEAP1 (0.47) | ALDH1A1KMT2AL3MBTL1MAPTKDM4E | |
| SCHEMBL21802552 | 0.70 | ALDH1A1 (0.49) | ALDH1A1KMT2AL3MBTL1KDM4EMEN1 | |
| SCHEMBL22686228 | 0.70 | ALDH1A1 (0.51) | ALDH1A1KMT2AL3MBTL1MAPTKDM4E | |
| SCHEMBL3879922 | 0.70 | LMNA (0.42) | ALDH1A1KMT2AL3MBTL1MAPTMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021209490-A1 | CYCLAMINEPHENYLAMINOQUINOLINES AS FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2021-10-21 | — | — | WO | disclosed |