Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | TACR3 | P29371 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 3/20 | 0.39 |
| ▸ | HTR2B | P41595 | 3/20 | 0.39 |
| ▸ | TACR2 | P21452 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28069309 | 0.81 | NCF1 (0.46) | NCF1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL13656748 | 0.77 | KMT2A (0.41) | ALDH1A1KMT2AMAPT | |
| SCHEMBL6495560 | 0.77 | LOXL2 (0.47) | NCF1ALDH1A1CYP1A2PTPN1PTPN11 | |
| Hydrochloric Acid SCHEMBL6495563 | 0.76 | LOXL2 (0.46) | NCF1ALDH1A1CYP1A2PTPN1PTPN11 | |
| SCHEMBL27487557 | 0.76 | MEN1 (0.43) | ALDH1A1CYP1A2CYP2C9HIF1AMEN1 | |
| Hydrochloric Acid SCHEMBL6495555 | 0.76 | LOXL2 (0.46) | NCF1ALDH1A1CYP1A2PTPN1PTPN11 | |
| SCHEMBL283103 | 0.75 | ALDH1A1 (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL6302737 | 0.75 | ALDH1A1 (0.48) | ALDH1A1CYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL9664845 | 0.75 | KMT2A (0.50) | ALDH1A1CYP1A2CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL264120 | 0.74 | NCF1 (0.52) | NCF1ALDH1A1CYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1213040-C | Serine protease inhibitors | LILLY CO ELI (US) | 2005-08-03 | — | — | CN | disclosed |
| CN-1438999-A | Serine protease inhibitors | LILLY CO ELI (US) | 2003-08-27 | — | — | CN | disclosed |