Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8701669 | 0.88 | SIGMAR1 (0.40) | SIGMAR1 | |
| SCHEMBL8699387 | 0.87 | SIGMAR1 (0.39) | SIGMAR1ALDH1A1TSHR | |
| SCHEMBL8699122 | 0.86 | SIGMAR1 (0.38) | SIGMAR1ALDH1A1HSD17B10 | |
| SCHEMBL8701033 | 0.79 | NPC1 (0.47) | ALDH1A1 | |
| SCHEMBL8699167 | 0.79 | SIGMAR1 (0.40) | SIGMAR1 | |
| SCHEMBL8695264 | 0.79 | SIGMAR1 (0.40) | SIGMAR1 | |
| SCHEMBL8698574 | 0.79 | CYP17A1 (0.41) | SIGMAR1 | |
| Hydrochloric Acid SCHEMBL8698582 | 0.78 | CYP17A1 (0.41) | SIGMAR1 | |
| SCHEMBL8698785 | 0.77 | SIGMAR1 (0.40) | SIGMAR1 | |
| SCHEMBL8696215 | 0.77 | SIGMAR1 (0.38) | SIGMAR1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5741800-A | ANTIINFLAMMATORY AGENT, ANTIALLERGENS | KNOLL AKTIENGESELLACHAFT (DE) | 1998-04-21 | — | — | US | disclosed |