Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | MMP12 | P39900 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | AGXT | P21549 | 2/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14448981 | 0.83 | ALDH1A1 (0.41) | GRM5PKMFFAR1FFAR4MMP2 | |
| SCHEMBL30881188 | 0.83 | ALDH1A1 (0.41) | GRM5PKMFFAR1FFAR4MMP2 | |
| SCHEMBL28532155 | 0.80 | NQO1 (0.36) | PKMFFAR4MMP2MMP12MMP1 | |
| SCHEMBL5969470 | 0.80 | GRM5 (0.42) | GRM5MMP2MMP12MMP1MMP9 | |
| SCHEMBL23093403 | 0.80 | MMP2 (0.39) | PKMFFAR1FFAR4MMP2MMP12 | |
| SCHEMBL6629935 | 0.80 | L3MBTL1 (0.44) | PKMFFAR1FFAR4MMP2MMP12 | |
| SCHEMBL28954128 | 0.80 | IDO1 (0.42) | IDO1ALDH1A1NPSR1HSD17B10MAOB | |
| SCHEMBL28717892 | 0.78 | IDO1 (0.41) | GRM5MMP2MMP12MMP1MMP9 | |
| SCHEMBL15524379 | 0.77 | ICMT (0.43) | PKMFFAR1FFAR4PIN1MPO | |
| SCHEMBL114463 | 0.75 | PARP10 (0.57) | PKMFFAR1FFAR4MMP2MMP12 |
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-111566103-B | Aminoimidazopyrazines as kinase inhibitors | 百时美施贵宝公司 | 2023-06-23 | — | — | CN | disclosed |
| CN-110520423-B | Aminotriazolopyridines as kinase inhibitors | 百时美施贵宝公司 | 2022-08-23 | — | — | CN | disclosed |
| CN-111566103-A | Aminoimidazopyrazines as kinase inhibitors | 百时美施贵宝公司 | 2020-08-21 | — | — | CN | disclosed |