Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.48 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.47 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 5/20 | 0.45 |
| ▸ | FLT1 | P17948 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | WNT3A | P56704 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | GRK2 | P25098 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2196171 | 0.89 | EPHX2 (0.50) | EPHX2KDRFLT1ALDH1A1WNT3A | |
| SCHEMBL2198240 | 0.89 | ALDH1A1 (0.54) | EPHX2ALDH1A1HPGDKMT2ANPSR1 | |
| SCHEMBL2198146 | 0.86 | CLK4 (0.50) | EPHX2ALDH1A1HPGDKMT2ANPSR1 | |
| SCHEMBL2198508 | 0.84 | BRD4 (0.46) | ALDH1A1HPGDKMT2ANPSR1LMNA | |
| SCHEMBL2198418 | 0.83 | PDE5A (0.42) | EPHX2ALDH1A1HPGDKMT2ANPSR1 | |
| SCHEMBL2199265 | 0.81 | CLK4 (0.51) | ALDH1A1HPGDKMT2AMAPTLMNA | |
| SCHEMBL2197230 | 0.80 | KDM4E (0.53) | ALDH1A1HPGDKMT2ANPSR1MAPT | |
| SCHEMBL13146629 | 0.79 | EPHX2 (0.47) | EPHX2KDRFLT1KMT2APOLB | |
| SCHEMBL2197333 | 0.79 | PDE5A (0.48) | EPHX2ALDH1A1HPGDKMT2ANPSR1 | |
| SCHEMBL2198662 | 0.79 | CYP3A4 (0.47) | EPHX2ALDH1A1MAPTLMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-7977360-B2 | Benzo[d]isoxazol-3-yl-amine compounds and their use as vanilloid receptor ligands | GRUENENTHAL GMBH (DE) | 2011-07-12 | — | — | US | claimed |
| US-7977360-B2 | Benzo[d]isoxazol-3-yl-amine compounds and their use as vanilloid receptor ligands | GRUENENTHAL GMBH (DE) | 2011-07-12 | — | — | US | disclosed |