Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | CTPS1 | P17812 | 9/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.51 |
| ▸ | PDE5A | O76074 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | PDE1A | P54750 | 1/20 | 0.50 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.50 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8249060 | 0.79 | MEN1 (0.49) | MEN1KMT2ACTPS1MAPTPDE5A | |
| SCHEMBL5599800 | 0.78 | SMN1; SMN2 (0.58) | MEN1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL25720785 | 0.76 | PDE5A (0.79) | MEN1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3607475 | 0.76 | PDE5A (0.70) | PDE5AKDM4EPDE1APDE1BPDE1C | |
| SCHEMBL3597144 | 0.74 | SMN1; SMN2 (0.57) | MEN1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11516149 | 0.74 | PDE5A (0.64) | MEN1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5599931 | 0.73 | PDE5A (0.53) | MEN1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10977240 | 0.72 | MAPT (0.71) | MEN1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3599789 | 0.72 | MAPT (0.46) | GAAMAPTNLRP3EGFR | |
| SCHEMBL11517104 | 0.72 | PDE5A (0.62) | MEN1KMT2ACYP1A2CYP3A4CYP2D6 |
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-2007017728-A2 | NOVEL HETEROCYCLIC COMPOUNDS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-02-15 | — | — | WO | claimed |
| WO-2007017728-A2 | NOVEL HETEROCYCLIC COMPOUNDS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-02-15 | — | — | WO | disclosed |