Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FGFR1 | P11362 | 2/20 | 0.33 |
| ▸ | SRC | P12931 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NSD2 | O96028 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL9728771 | 0.87 | TAAR1 (0.34) | CYP1A2LMNA | |
| SCHEMBL3873200 | 0.79 | NOTUM (0.37) | TSHR | |
| SCHEMBL15636867 | 0.79 | CA1 (0.32) | — | |
| SCHEMBL5047787 | 0.79 | CD44 (0.35) | CYP1A2CYP2A6TSHR | |
| SCHEMBL15637369 | 0.78 | CYP2A6 (0.43) | CYP2A6LMNATSHR | |
| SCHEMBL11405846 | 0.76 | IDO1 (0.40) | LMNA | |
| SCHEMBL456350 | 0.71 | CYP2A6 (0.44) | CYP1A2CYP2A6LMNATSHR | |
| SCHEMBL8050739 | 0.71 | GRIA1 (0.36) | SRCCYP1A2LMNATSHR | |
| SCHEMBL15635850 | 0.70 | CYP2A6 (0.33) | FGFR1SRCCYP1A2CYP2A6LMNA | |
| SCHEMBL15287170 | 0.69 | TDO2 (0.41) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011063223-A1 | TETRAHYDRO-β-CARBOLINE DERIVATIVES, SYNTHESIS AND USE THEREOF | SOUTHERN RESEARCH INSTITUTE (US) | 2011-05-26 | — | — | WO | disclosed |