Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALML3 | P27482 | 6/20 | 0.58 |
| ▸ | MAOA | P21397 | 11/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5236580 | 1.00 | CALML3 (0.58) | CALML3MAOACYP2C19CYP2C9MAOB | |
| SCHEMBL5625330 | 1.00 | CALML3 (0.58) | CALML3MAOACYP2C19CYP2C9MAOB | |
| Trifluoroacetic Acid SCHEMBL5623895 | 0.95 | CALML3 (0.54) | CALML3MAOACYP2C19CYP2C9MAOB | |
| SCHEMBL4016280 | 0.91 | CALML3 (0.47) | CALML3MAOA | |
| SCHEMBL7256130 | 0.91 | CALML3 (0.47) | CALML3MAOA | |
| SCHEMBL5233293 | 0.89 | CALML3 (0.48) | CALML3MAOACYP2C19CYP2C9MAOB | |
| SCHEMBL5833839 | 0.89 | CALML3 (0.48) | CALML3MAOACYP2C19CYP2C9MAOB | |
| SCHEMBL7256142 | 0.88 | CALML3 (0.45) | CALML3MAOACYP3A4 | |
| SCHEMBL6827066 | 0.88 | MAOA (0.64) | CALML3MAOAMAOB | |
| SCHEMBL6827071 | 0.88 | MAOA (0.64) | CALML3MAOAMAOB |
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-2004113329-A1 | OXAZOLE DERIVATIVES AS ANTIBACTERIAL AGENTS | ORCHID CHEMICALS AND PHARMACEUTICALS LTD. (IN) | 2004-12-29 | — | — | WO | disclosed |
| WO-2003097640-A1 | OXAZOLIDINONE DERIVATIVES AS ANTIBACTERIAL AGENTS | ORCHID CHEMICALS & PHARMACEUTICALS LTD. (IN) | 2003-11-27 | — | — | WO | disclosed |