Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 5/20 | 0.36 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.36 |
| ▸ | NQO2 | P16083 | 2/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 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 | |
|---|---|---|---|---|
| SCHEMBL4738147 | 0.93 | NQO2 (0.42) | CYP19A1CYP11B2NQO2MTNR1AMTNR1B | |
| SCHEMBL4737851 | 0.88 | CYP19A1 (0.32) | MIFCYP26A1CYP19A1CYP11B2NQO2 | |
| SCHEMBL4737211 | 0.83 | CYP19A1 (0.34) | CYP19A1CYP11B2NPC1RAB9AMEN1 | |
| SCHEMBL4735019 | 0.81 | NQO2 (0.38) | CYP19A1CYP11B2NQO2MTNR1AMTNR1B | |
| SCHEMBL4736286 | 0.79 | — | — | |
| SCHEMBL4739793 | 0.77 | TSHR (0.36) | CYP19A1CYP11B2NPC1RAB9AMEN1 | |
| SCHEMBL4739791 | 0.77 | TSHR (0.36) | CYP19A1CYP11B2NPC1RAB9AMEN1 | |
| SCHEMBL4735242 | 0.77 | FNTA (0.31) | — | |
| SCHEMBL4735017 | 0.77 | — | — | |
| SCHEMBL4736255 | 0.76 | ALDH1A1 (0.39) | RAB9AMEN1KMT2AALDH1A1MAPT |
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-2008071765-A1 | PHARMACEUTICALLY ACTIVE SPIRO-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | NYCOMED GMBH (DE) | 2008-06-19 | — | — | WO | disclosed |