Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | AGER | Q15109 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Methane SCHEMBL11292355 | 0.97 | MEN1 (0.39) | MEN1KMT2ASMN1; SMN2ESR1AGER | |
| Methane SCHEMBL11331534 | 0.96 | KMT2A (0.41) | MEN1KMT2ASMN1; SMN2ESR1AGER | |
| Methane SCHEMBL11301610 | 0.87 | ALDH1A1 (0.35) | MEN1KMT2ASMN1; SMN2ESR1MAPT | |
| Benzophenone SCHEMBL11269386 | 0.86 | TSHR (0.40) | MEN1KMT2ASMN1; SMN2ESR1CYP2D6 | |
| Methane SCHEMBL11302737 | 0.85 | ALDH1A1 (0.35) | MEN1KMT2ASMN1; SMN2ESR1CYP2D6 | |
| Methane SCHEMBL11314925 | 0.84 | ALDH1A1 (0.35) | MEN1KMT2ASMN1; SMN2ESR1CYP2D6 | |
| Methane SCHEMBL11305895 | 0.84 | ALDH1A1 (0.35) | MEN1KMT2ASMN1; SMN2ESR1CYP2D6 | |
| SCHEMBL11325308 | 0.84 | PTGS2 (0.44) | MAPTTSHRLMNACYP1A2 | |
| Benzophenone SCHEMBL11271776 | 0.84 | TSHR (0.40) | MEN1KMT2ASMN1; SMN2ESR1MAPT | |
| Methane SCHEMBL11291301 | 0.83 | ALDH1A1 (0.36) | MEN1KMT2ASMN1; SMN2CYP2D6CYP3A4 |
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-4362738-A | ANTIINFLAMMATORIES | DR. KARL THOMAE GMBH (DE) | 1982-12-07 | — | — | US | disclosed |