Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM2 | O94759 | 5/20 | 0.67 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.46 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28808958 | 1.00 | TRPM2 (0.67) | TRPM2AKR1C2AKR1C1MEN1KMT2A | |
| SCHEMBL28947487 | 0.89 | TRPM2 (0.67) | TRPM2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28947486 | 0.89 | TRPM2 (0.67) | TRPM2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28809032 | 0.83 | TRPM2 (0.55) | TRPM2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28809037 | 0.83 | TRPM2 (0.55) | TRPM2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28809610 | 0.81 | TRPM2 (1.00) | TRPM2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28809613 | 0.81 | TRPM2 (1.00) | TRPM2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8064096 | 0.76 | MEN1 (0.61) | MEN1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8064094 | 0.76 | MEN1 (0.61) | MEN1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28808953 | 0.75 | TRPM2 (0.67) | TRPM2MEN1KMT2ANPC1RAB9A |
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-114831977-A | Application of benzoic acid derivatives as TRPM2 protein inhibitors | 北京大学 | 2022-08-02 | — | — | CN | claimed |
| CN-114831977-B | Application of benzoic acid derivative as TRPM2 protein inhibitor | 北京大学 | 2023-12-19 | — | — | CN | disclosed |
| CN-114831977-A | Application of benzoic acid derivatives as TRPM2 protein inhibitors | 北京大学 | 2022-08-02 | — | — | CN | disclosed |