Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30439285 | 0.94 | PARP1 (0.39) | PARP1POLBP2RX7 | |
| SCHEMBL21100022 | 0.85 | CNR2 (0.35) | POLB | |
| SCHEMBL16518772 | 0.84 | CNR1 (0.32) | PARP1 | |
| SCHEMBL29484187 | 0.84 | HSD17B10 (0.52) | HSD11B1 | |
| SCHEMBL19658364 | 0.81 | ACE (0.35) | — | |
| SCHEMBL21100019 | 0.81 | MAPT (0.36) | POLB | |
| SCHEMBL357242 | 0.77 | HSD17B10 (0.50) | — | |
| SCHEMBL9893215 | 0.77 | HSD17B10 (0.50) | — | |
| SCHEMBL4959104 | 0.77 | HSD17B10 (0.50) | — | |
| SCHEMBL29972921 | 0.77 | DPP4 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2850061-B1 | HALOGENATED INDOLE DERIVATIVES FOR PHOTODYNAMIC THERAPY | NANOQUANTUM SCIENCES INC (US) | 2020-09-16 | — | — | EP | disclosed |
| US-9572881-B2 | Halogenated compounds for photodynamic therapy | NANOQUANTUM SCIENCES, INC. (US) | 2017-02-21 | — | — | US | disclosed |