Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 2/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30421069 | 1.00 | ESR2 (0.46) | ESR2HDAC7PSMB5PTGDR2RAB9A | |
| SCHEMBL19464511 | 0.84 | HDAC7 (0.49) | ESR2HDAC7PSMB5PTGDR2RAB9A | |
| SCHEMBL12551788 | 0.82 | MGLL (0.50) | ESR2RAB9AMEN1KMT2ANPC1 | |
| SCHEMBL8067754 | 0.80 | CA2 (0.54) | ESR2BACE1ALOX5MGLLKDM4E | |
| SCHEMBL3655307 | 0.78 | PTGDR2 (0.41) | ESR2PTGDR2TP53BACE1ALOX5 | |
| SCHEMBL28972658 | 0.78 | ESR2 (0.40) | ESR2MEN1KMT2ABACE1ALOX5 | |
| SCHEMBL3110322 | 0.78 | KMT2A (0.44) | ESR2PTGDR2RAB9AMEN1KMT2A | |
| SCHEMBL3356056 | 0.77 | ALOX5 (0.61) | ESR2HDAC7PSMB5PTGDR2RAB9A | |
| SCHEMBL21933 | 0.76 | ALDH1A1 (0.48) | MEN1KMT2ABACE1MGLLALDH1A1 | |
| SCHEMBL3005820 | 0.76 | ELANE (0.52) | ESR2HDAC7PSMB5PTGDR2RAB9A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023088095-A1 | 7-FLUORO-5-SUBSTITUTED TRYPTAMINE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF | 宁波大学 | 2023-05-25 | — | — | WO | disclosed |
| CN-112341404-B | Thiazole derivative or salt, isomer, preparation method and application thereof | 成都苑东生物制药股份有限公司 | 2023-05-23 | — | — | CN | disclosed |
| CN-115784965-A | 7-fluoro-5-substituted tryptamine compound and preparation method and application thereof | 宁波大学 | 2023-03-14 | — | — | CN | disclosed |
| CN-110790641-B | Method for producing compound having oxydifluoromethylene skeleton | 大金工业株式会社 | 2023-02-28 | — | — | CN | disclosed |
| CN-115490607-A | C 2 Synthesis method of-symmetrical chiral aryl iodide catalyst | 南通大学 | 2022-12-20 | — | — | CN | disclosed |
| CN-114249681-A | 7-fluoro-5-substituted tryptamine compound and preparation method and application thereof | 宁波大学 | 2022-03-29 | — | — | CN | disclosed |
| CN-112341404-A | Novel thiazole derivative or salt, isomer, preparation method and application thereof | 成都苑东生物制药股份有限公司 | 2021-02-09 | — | — | CN | disclosed |