Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | KIFC1 | Q9BW19 | 2/20 | 0.48 |
| ▸ | KIF11 | P52732 | 1/20 | 0.47 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 9/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25675522 | 0.82 | HDAC1 (0.55) | CA12CA1CA2CA4HDAC1 | |
| SCHEMBL30230685 | 0.81 | MAP3K7 (0.42) | PIM1HDAC1HDAC6KCNH2 | |
| SCHEMBL25676480 | 0.81 | CA12 (0.52) | CA12CA1CA2CA4TYRO3 | |
| Trifluoroacetic Acid SCHEMBL30061795 | 0.81 | HDAC1 (0.42) | TYRO3PIM1HDAC1HDAC6 | |
| SCHEMBL30060113 | 0.80 | HDAC1 (0.45) | TYRO3PIM1HDAC1HDAC6NPC1 | |
| SCHEMBL30060144 | 0.80 | HDAC1 (0.45) | TYRO3PIM1HDAC1HDAC6NPC1 | |
| SCHEMBL25676535 | 0.80 | USP30 (0.52) | — | |
| SCHEMBL1580017 | 0.78 | TAS1R3 (0.58) | KIFC1HDAC4NPC1HPGDRAB9A | |
| Trifluoroacetic Acid SCHEMBL30062036 | 0.78 | HDAC1 (0.43) | TYRO3PIM1HDAC1HDAC6NPC1 | |
| Trifluoroacetic Acid SCHEMBL30230512 | 0.78 | HDAC1 (0.43) | TYRO3PIM1HDAC1HDAC6NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023099561-A1 | SUBSTITUTED N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS | MISSION THERAPEUTICS LIMITED (GB) | 2023-06-08 | — | — | WO | disclosed |