Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 6/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 6/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20293305 | 1.00 | PARP1 (0.40) | PARP1PARP2MEN1KMT2ANPSR1 | |
| SCHEMBL20296159 | 0.92 | PTGDR2 (0.45) | MEN1KMT2ANPSR1PTGDR2TMEM97 | |
| SCHEMBL30740274 | 0.92 | PTGDR2 (0.45) | MEN1KMT2ANPSR1PTGDR2TMEM97 | |
| SCHEMBL14991147 | 0.80 | MEN1 (0.49) | PARP1PARP2MEN1KMT2ANPSR1 | |
| SCHEMBL20293210 | 0.80 | PDCD1 (0.42) | PDCD1CD274 | |
| SCHEMBL20293007 | 0.78 | PDCD1 (0.53) | PDCD1CD274 | |
| SCHEMBL17982156 | 0.77 | S1PR5 (0.46) | MEN1KMT2ANPSR1PTGDR2GRM5 | |
| SCHEMBL505281 | 0.77 | GRM5 (0.48) | MEN1KMT2ANPSR1CYP3A4GRM5 | |
| SCHEMBL30740215 | 0.77 | PDCD1 (0.52) | PDCD1CD274 | |
| SCHEMBL20296086 | 0.77 | PDCD1 (0.51) | PDCD1CD274 |
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-110267953-B | Tetrahydroimidazo [4,5-C ] pyridine derivatives as inducers of PD-L1 internalization | 因赛特公司 | 2022-12-20 | — | — | CN | disclosed |