Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 3/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.34 |
| ▸ | PARP11 | Q9NR21 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13779510 | 0.85 | NOTUM (0.40) | NOTUMPARP1PARP10PARP11CA2 | |
| SCHEMBL24841674 | 0.79 | NOTUM (0.40) | NOTUMPARP1PARP10PARP11 | |
| SCHEMBL13952173 | 0.79 | NOTUM (0.40) | NOTUMPARP1PARP10PARP11BRD4 | |
| SCHEMBL30684831 | 0.78 | NOTUM (0.40) | NOTUMPARP1PKM | |
| SCHEMBL3874122 | 0.78 | NOTUM (0.40) | NOTUMPARP1PKM | |
| SCHEMBL19286543 | 0.77 | NOTUM (0.38) | NOTUMPARP1PARP10PARP11 | |
| SCHEMBL24854401 | 0.77 | NOTUM (0.38) | NOTUMPARP1PARP10PARP11BRD4 | |
| Hydrochloric Acid SCHEMBL28637723 | 0.76 | NOTUM (0.39) | NOTUMPARP1PKM | |
| SCHEMBL9910074 | 0.75 | GRIA1 (0.38) | PARP1CA2DRD2BCHE | |
| SCHEMBL30955293 | 0.74 | MAP4K1 (0.30) | NOTUMPARP10PARP11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024133499-A1 | GLYCINE DERIVATIVES WITH P2X4 RECEPTOR-BLOCKING ACTIVITY AS DIAGNOSTICS AND FOR THE TREATMENT OF PAIN, INFLAMMATION, CANCER, AND OTHER P2X4 RECEPTOR-RELATED DISEASES | RHEINISCHE-FRIEDRICH-WILHELMS-UNIVERSITÄT BONN (DE) | 2024-06-27 | — | — | WO | disclosed |
| WO-2021039961-A1 | RING-FUSED PYRAZOLE DERIVATIVE | 大日本住友製薬株式会社 | 2021-03-04 | — | — | WO | disclosed |