Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.50 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.50 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28570981 | 1.00 | KMT2A (0.55) | KMT2AMAPTTDP1MEN1SMN1; SMN2 | |
| SCHEMBL18119752 | 0.89 | KMT2A (0.56) | KMT2AMAPTTDP1MEN1SMN1; SMN2 | |
| SCHEMBL8895665 | 0.86 | KMT2A (0.51) | KMT2AMAPTTDP1MEN1SMN1; SMN2 | |
| SCHEMBL19232114 | 0.83 | ALDH1A1 (0.64) | KMT2AMAPTTDP1MEN1SMN1; SMN2 | |
| SCHEMBL19707984 | 0.83 | KMT2A (0.66) | KMT2AMAPTTDP1MEN1SMN1; SMN2 | |
| SCHEMBL27142231 | 0.82 | CXCR2 (0.54) | KMT2AMAPTMEN1SMN1; SMN2NPC1 | |
| SCHEMBL27126721 | 0.82 | CXCR2 (0.54) | KMT2AMAPTMEN1SMN1; SMN2NPC1 | |
| SCHEMBL19987418 | 0.81 | ALDH1A1 (0.56) | KMT2AMAPTTDP1MEN1SMN1; SMN2 | |
| SCHEMBL6356610 | 0.81 | POLB (0.47) | KMT2AHTTPKMPOLBRECQL | |
| SCHEMBL11435364 | 0.80 | KMT2A (0.58) | KMT2AMAPTTDP1MEN1SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112778154-B | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2022-05-13 | — | — | CN | disclosed |
| CN-112778154-A | Aryl alkyl ether compound and derivative thereof, preparation method, pharmaceutical composition and application | 中国药科大学 | 2021-05-11 | — | — | CN | disclosed |