Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | HTR6 | P50406 | 2/20 | 0.53 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | NAMPT | P43490 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11212070 | 0.85 | TSHR (0.56) | TSHRPOLBMAPK1PTGS2PTGS1 | |
| SCHEMBL16797504 | 0.84 | MAPK1 (0.81) | TSHRPOLBMAPK1HTR6GAA | |
| SCHEMBL4022069 | 0.81 | POLB (0.50) | TSHRPOLBMAPK1PTGS2PTGS1 | |
| SCHEMBL8046997 | 0.81 | HTR6 (0.69) | TSHRPOLBMAPK1HTR6GAA | |
| SCHEMBL1989639 | 0.81 | MEN1 (0.46) | TSHRPOLBMAPK1PTGS2PTGS1 | |
| SCHEMBL4618678 | 0.81 | HTR6 (0.58) | TSHRPOLBMAPK1HTR6GAA | |
| SCHEMBL9633094 | 0.80 | CA1 (0.58) | TSHRPOLBMAPK1HTR6GAA | |
| SCHEMBL18052468 | 0.80 | ALDH1A1 (0.53) | TSHRPOLBMAPK1CTDSP1NAMPT | |
| SCHEMBL1178903 | 0.79 | PTGS2 (0.53) | TSHRPOLBMAPK1PTGS2PTGS1 | |
| Anisole SCHEMBL3019246 | 0.78 | PTGS2 (0.50) | TSHRPOLBPTGS2PTGS1CTDSP1 |
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-4554381-A | BORON TRIFLUORIDE, HYDROFLUORIC ACID | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1985-11-19 | — | — | US | disclosed |