Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2837882 | 0.77 | ADORA2A (0.35) | MEN1KMT2AADORA2AADORA2B | |
| SCHEMBL7749986 | 0.74 | PIM1 (0.49) | CYP3A4TSHRCYP1A2CYP2D6MAPT | |
| SCHEMBL14147839 | 0.74 | ALDH1A1 (0.46) | MAPTALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL21011371 | 0.73 | MAPT (0.37) | CYP3A4TSHRCYP1A2CYP2D6MAPT | |
| SCHEMBL2829878 | 0.72 | S100A4 (0.64) | S100A4CYP3A4TSHRMAPTALDH1A1 | |
| SCHEMBL2358023 | 0.70 | CYP1A2 (0.38) | S100A4CYP3A4PARP1CYP1A2MAPT | |
| SCHEMBL4786230 | 0.70 | ALDH1A1 (0.45) | MAPTALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL2285808 | 0.70 | CYP3A4 (0.70) | S100A4CYP3A4TSHRMAPTALDH1A1 | |
| SCHEMBL29674860 | 0.70 | CYP3A4 (0.70) | S100A4CYP3A4TSHRMAPTALDH1A1 | |
| SCHEMBL28369623 | 0.69 | ADORA2A (0.33) | CYP3A4TSHRCYP1A2CYP2D6MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001042149-A1 | METHOD OF INHIBITING CORROSION OF YELLOW METAL SURFACES IN AQUEOUS SYSTEMS | NALCO CHEMICAL COMPANY (US) | 2001-06-14 | — | — | WO | claimed |
| WO-2001042149-A1 | METHOD OF INHIBITING CORROSION OF YELLOW METAL SURFACES IN AQUEOUS SYSTEMS | NALCO CHEMICAL COMPANY (US) | 2001-06-14 | — | — | WO | disclosed |