Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8415962 | 0.83 | TSHR (0.38) | CYP4F2CYP4A11TSHRLMNAKDM4E | |
| SCHEMBL8283846 | 0.76 | DPP4 (0.35) | — | |
| SCHEMBL7337382 | 0.75 | TSHR (0.33) | CYP3A4TP53TSHRALDH1A1NPSR1 | |
| SCHEMBL7344565 | 0.75 | TSHR (0.33) | CYP3A4TP53TSHRALDH1A1NPSR1 | |
| SCHEMBL8415955 | 0.73 | — | — | |
| SCHEMBL4691009 | 0.73 | TSHR (0.43) | CYP3A4TP53TSHRALDH1A1NPSR1 | |
| SCHEMBL8283842 | 0.72 | CYP2C19 (0.30) | CYP2C19 | |
| SCHEMBL8415954 | 0.72 | TP53 (0.34) | TP53 | |
| SCHEMBL3826644 | 0.71 | — | — | |
| SCHEMBL28002 | 0.71 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1599446-B1 | AN IMPROVED PROCESS FOR THE PREPARATION OF GABALACTAM | HIKAL LTD (IN) | 2009-08-12 | — | — | EP | disclosed |