Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | PRMT1 | Q99873 | 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 | |
|---|---|---|---|---|
| SCHEMBL11683495 | 0.82 | S1PR2 (0.30) | S1PR2S1PR1S1PR3 | |
| SCHEMBL11683803 | 0.77 | TSHR (0.41) | CYP2D6TSHRRAB9A | |
| Aniline SCHEMBL11686945 | 0.74 | CYP2D6 (0.41) | CYP2D6TSHRRAB9APRMT1 | |
| Aniline SCHEMBL27974868 | 0.72 | TSHR (0.46) | CYP2D6TSHRNPC1RAB9A | |
| Aniline SCHEMBL11686010 | 0.72 | CYP2D6 (0.40) | CYP2D6TSHRPRMT1 | |
| Aniline SCHEMBL8010474 | 0.71 | TSHR (0.44) | CYP2D6S1PR2S1PR1S1PR3TSHR | |
| Aniline SCHEMBL11682922 | 0.71 | CYP2D6 (0.39) | CYP2D6TSHRPRMT1 | |
| Aniline SCHEMBL10806060 | 0.70 | TSHR (0.52) | CYP2D6TSHR | |
| Aniline SCHEMBL27650765 | 0.69 | TSHR (0.50) | CYP2D6TSHR | |
| Aniline SCHEMBL9282904 | 0.67 | S1PR2 (0.43) | CYP2D6S1PR2S1PR1S1PR3TSHR |
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 |