Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 1/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.30 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Aniline SCHEMBL11684073 | 0.82 | CYP2D6 (0.37) | S1PR2S1PR1S1PR3 | |
| SCHEMBL11683803 | 0.81 | TSHR (0.41) | — | |
| SCHEMBL11684241 | 0.76 | CYP2D6 (0.33) | — | |
| SCHEMBL11683545 | 0.74 | CYP2D6 (0.31) | — | |
| SCHEMBL11686664 | 0.73 | CYP2D6 (0.31) | — | |
| SCHEMBL9055171 | 0.67 | ALDH1A1 (0.42) | — | |
| SCHEMBL27275375 | 0.66 | KMT2A (0.37) | S1PR2S1PR1S1PR3 | |
| SCHEMBL11684369 | 0.64 | TSHR (0.44) | — | |
| SCHEMBL28389450 | 0.63 | CA1 (0.44) | — | |
| SCHEMBL15842492 | 0.62 | ALDH1A1 (0.43) | — |
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-4055557-A | MONOAZO DYES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-10-25 | — | — | US | disclosed |