Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9869890 | 0.93 | NOS3 (0.35) | TSHRHTTMEN1THRBKMT2A | |
| SCHEMBL9870493 | 0.91 | ALDH1A1 (0.38) | TSHRHTTMEN1THRBKMT2A | |
| SCHEMBL9870711 | 0.89 | ALDH1A1 (0.39) | TSHRHTTMEN1THRBKMT2A | |
| SCHEMBL6053634 | 0.88 | CA12 (0.43) | TSHRHTTCYP3A4NOS3NOS1 | |
| SCHEMBL28638220 | 0.86 | CA12 (0.42) | TSHRHTTCYP3A4NOS3NOS1 | |
| SCHEMBL31257889 | 0.86 | CA12 (0.42) | TSHRHTTCYP3A4NOS3NOS1 | |
| SCHEMBL79082 | 0.86 | CA12 (0.42) | TSHRHTTCYP3A4NOS3NOS1 | |
| SCHEMBL148184 | 0.86 | CA12 (0.42) | TSHRHTTCYP3A4NOS3NOS1 | |
| SCHEMBL1618010 | 0.86 | CA12 (0.42) | TSHRHTTCYP3A4NOS3NOS1 | |
| Ammonia Solution, Strong SCHEMBL27696161 | 0.86 | CA12 (0.42) | TSHRHTTCYP3A4NOS3NOS1 |
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-5026492-A | Synergistic; improved wear resistance in internal combustion engines | EXXON RESEARCH & ENGINEERING COMPANY (US) | 1991-06-25 | — | — | US | disclosed |