Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 11/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.31 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10033085 | 0.83 | HTR2A (0.40) | KDM1AHTR2CHTR2BALDH1A1TDP1 | |
| SCHEMBL10033089 | 0.83 | HTR2A (0.40) | KDM1AHTR2CHTR2BALDH1A1TDP1 | |
| SCHEMBL1709495 | 0.77 | MEN1 (0.38) | HTR2CHTR2BSMN1; SMN2TP53MEN1 | |
| SCHEMBL16212239 | 0.68 | HTR2C (0.48) | KDM1AHTR2CHTR2BKDM1BMAOA | |
| SCHEMBL6905308 | 0.67 | KDM1A (0.59) | KDM1AHTR2CHTR2BKDM1BMAOA | |
| SCHEMBL6901210 | 0.67 | KDM1A (0.59) | KDM1AHTR2CHTR2BKDM1BMAOA | |
| SCHEMBL10033087 | 0.67 | TSHR (0.30) | TSHR | |
| SCHEMBL10032839 | 0.67 | KDM1A (0.40) | KDM1AL3MBTL1KDM1BTP53MAOA | |
| SCHEMBL10032974 | 0.66 | SIGMAR1 (0.44) | KDM1AHTR2CMAOAMAOB | |
| SCHEMBL10033111 | 0.66 | HTR2C (0.35) | HTR2CHTR2BALDH1A1TDP1TP53 |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |