Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 4/20 | 0.38 |
| ▸ | AGXT | P21549 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.34 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL487468 | 0.79 | IDO1 (0.48) | ERN1FFAR1IDO1AGXTMAOB | |
| SCHEMBL13418181 | 0.78 | TP53 (0.42) | IDO1TP53RAB9ASMN1; SMN2 | |
| SCHEMBL18025680 | 0.75 | ENPP2 (0.47) | SMN1; SMN2MRGPRX4 | |
| SCHEMBL3150055 | 0.75 | ENPP2 (0.56) | ERN1CA2LMNAGABRA1GABRG2 | |
| SCHEMBL29713840 | 0.75 | ENPP2 (0.56) | ERN1CA2LMNAGABRA1GABRG2 | |
| SCHEMBL2889827 | 0.74 | CYP4F2 (0.54) | ERN1FFAR1IDO1AGXTCA2 | |
| SCHEMBL25485110 | 0.74 | IDO1 (0.47) | IDO1AGXTCYP4F2CYP4A11GABRA1 | |
| SCHEMBL2567350 | 0.74 | MRGPRX4 (0.49) | ERN1FFAR1IDO1AGXTCYP4F2 | |
| SCHEMBL17934442 | 0.74 | ENPP2 (0.54) | NFKB1SMN1; SMN2 | |
| SCHEMBL2340242 | 0.73 | TSHR (0.50) | IDO1AGXTCA2TP53LMNA |
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-2012055888-A1 | DIAZA-SPIRO[5.5]UNDECANES USEFUL AS OREXIN RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 2012-05-03 | — | — | WO | disclosed |