Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21391974 | 1.00 | PTGS1 (0.52) | PTGS1RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL20468344 | 0.93 | PTGS1 (0.56) | PTGS1RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL28908365 | 0.87 | PTGS1 (0.54) | PTGS1RAB9AMAPTKDM4ECYP1A2 | |
| SCHEMBL23730425 | 0.86 | PTGS1 (0.61) | PTGS1CRBNGLAPOLBGAA | |
| SCHEMBL26416602 | 0.86 | CYP1A2 (0.66) | PTGS1RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL29996855 | 0.86 | CYP1A2 (0.66) | PTGS1RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL29771708 | 0.84 | PTGS1 (0.59) | PTGS1RAB9AMAPTCRBNGLA | |
| SCHEMBL28339137 | 0.84 | PTGS1 (0.59) | PTGS1RAB9AMAPTCRBNGLA | |
| SCHEMBL14972697 | 0.84 | CYP1A2 (0.64) | PTGS1RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL6814891 | 0.84 | KDM4E (0.55) | PTGS1RAB9ASMN1; SMN2MAPTKDM4E |
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-112225676-B | Fluorine-containing aromatic diamine compound and preparation method thereof, fluorine-containing polyimide compound and preparation method thereof | 深圳市道尔顿电子材料有限公司 | 2023-03-10 | — | — | CN | disclosed |