Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | GABRE | P78334 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.35 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.35 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23970627 | 1.00 | TDP1 (0.38) | TDP1LMNAKMT2AGABRPGABRD | |
| SCHEMBL30159250 | 0.88 | TDP1 (0.39) | TDP1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL23970518 | 0.88 | TDP1 (0.39) | TDP1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL23971334 | 0.82 | TDP1 (0.37) | TDP1LMNAKMT2AGABRPGABRD | |
| SCHEMBL23971072 | 0.81 | GABRP (0.43) | LMNAKMT2AGABRPGABRDGABRA1 | |
| SCHEMBL23971359 | 0.80 | ACACB (0.40) | LMNAKMT2AATRMAPKAPK2 | |
| SCHEMBL30159082 | 0.79 | GABRP (0.50) | KMT2AGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28950501 | 0.79 | PSMD10 (0.38) | LMNAKMT2A | |
| SCHEMBL30158994 | 0.79 | PSMD10 (0.38) | LMNAKMT2A | |
| SCHEMBL24850654 | 0.77 | KMT2A (0.32) | LMNAKMT2AATRMAPKAPK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115551862-B | Macrocyclic inhibitors of peptidyl arginine deiminase | 吉利德科学公司 | 2024-04-12 | — | — | CN | disclosed |