Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TLR2 | O60603 | 1/20 | 0.41 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL378420 | 0.77 | TACR1 (0.48) | TAAR1POLBNPC1RAB9AMEN1 | |
| SCHEMBL5081412 | 0.77 | KMT2A (0.59) | TAAR1POLBNPC1RAB9AMEN1 | |
| SCHEMBL378386 | 0.74 | TACR1 (0.57) | POLBNPC1RAB9AMEN1KMT2A | |
| SCHEMBL7899560 | 0.74 | HTT (0.43) | POLBMEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL379276 | 0.72 | HPGD (0.44) | TAAR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL21541001 | 0.70 | TAAR1 (0.60) | TAAR1POLBHPGDTLR2TLR1 | |
| SCHEMBL22179326 | 0.69 | TAAR1 (0.66) | TAAR1POLBNPC1RAB9AMEN1 | |
| SCHEMBL22179071 | 0.69 | TAAR1 (0.66) | TAAR1POLBNPC1RAB9AMEN1 | |
| SCHEMBL22622421 | 0.69 | TAAR1 (0.66) | TAAR1POLBNPC1RAB9AMEN1 | |
| SCHEMBL22179328 | 0.69 | TAAR1 (0.66) | TAAR1POLBNPC1RAB9AMEN1 |
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-2408745-A1 | PIPERIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2012-01-25 | — | — | EP | disclosed |