Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | KATNA1 | O75449 | 1/20 | 0.34 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.31 |
| ▸ | KIT | P10721 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5821767 | 0.86 | ESR1 (0.36) | PTGS2SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL5820973 | 0.85 | ALDH1A1 (0.43) | NPC1RAB9ALMNAALDH1A1HTT | |
| SCHEMBL5822048 | 0.85 | PTK2 (0.35) | PTK2CYP1A1CYP1A2CYP1B1PTGS2 | |
| SCHEMBL5820891 | 0.83 | ALDH1A1 (0.41) | PTGS2HPGDNPC1RAB9ADHFR | |
| SCHEMBL5815689 | 0.81 | GRIA1 (0.36) | PTGS2ALDH1A1TP53RXFP1 | |
| SCHEMBL5819683 | 0.80 | HCAR1 (0.34) | PTGS2SMN1; SMN2ALDH1A1HTTKMT2A | |
| SCHEMBL5821417 | 0.71 | ALDH1A1 (0.36) | LMNAMAPTALDH1A1KMT2A | |
| SCHEMBL5819681 | 0.71 | CA9 (0.43) | PTGS2ALDH1A1KMT2A | |
| SCHEMBL5822322 | 0.71 | CA9 (0.43) | PTGS2ALDH1A1KMT2A | |
| SCHEMBL5821281 | 0.71 | PTGS2 (0.38) | PTGS2MAPTKMT2AKDR |
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-2006129181-A2 | PREPARATION OF 4-PYRIMIDONE DERIVATIVES FOR TREATING INFLAMMATORY DISEASES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2006-12-07 | — | — | WO | disclosed |
| WO-2006102674-A2 | DIPHENYLHETEROCYCLE CHOLESTEROL ABSORPTION INHIBITORS | MICROBIA, INC. (US) | 2006-09-28 | — | — | WO | disclosed |