Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | P2RY1 | P47900 | 6/20 | 0.32 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.32 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.31 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 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 | |
|---|---|---|---|---|
| SCHEMBL231343 | 0.85 | CA2 (0.41) | CA2TDP1ALDH1A1TSHRALOX5 | |
| Ammonia Solution, Strong SCHEMBL28823003 | 0.83 | CA2 (0.39) | CA2TDP1ALDH1A1TSHRALOX5 | |
| SCHEMBL805460 | 0.79 | P2RY1 (0.41) | CA2TDP1ALDH1A1TSHRP2RY1 | |
| SCHEMBL19367716 | 0.79 | CA2 (0.37) | CA2TDP1ALDH1A1TSHRALOX5 | |
| SCHEMBL24858173 | 0.79 | CA2 (0.41) | CA2TDP1ALDH1A1TSHRALOX5 | |
| SCHEMBL25053731 | 0.79 | CA2 (0.37) | CA2TDP1ALDH1A1TSHRALOX5 | |
| SCHEMBL18235328 | 0.79 | CA2 (0.37) | CA2TDP1ALDH1A1TSHRALOX5 | |
| SCHEMBL2616434 | 0.74 | NAPRT (0.41) | CA2TDP1ALDH1A1TSHRLMNA | |
| SCHEMBL21718444 | 0.74 | CA2 (0.39) | CA2TDP1ALDH1A1TSHRLMNA | |
| SCHEMBL20953861 | 0.74 | CA2 (0.39) | CA2TDP1ALDH1A1TSHRALOX5 |
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-2023280280-A1 | FUSED-RING COMPOUND THAT ACTS AS KRAS G12D INHIBITOR | 微境生物医药科技(上海)有限公司 | 2023-01-12 | — | — | WO | disclosed |