Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | KDM4A | O75164 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL4169345 | 0.76 | TAAR1 (0.46) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL4178223 | 0.76 | TAAR1 (0.46) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL4161045 | 0.76 | TAAR1 (0.46) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL21131786 | 0.76 | TAAR1 (0.43) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL23049820 | 0.74 | NR3C1 (0.48) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL5026910 | 0.72 | TAAR1 (0.52) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL20651209 | 0.70 | TAAR1 (0.43) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL15463028 | 0.70 | TAAR1 (0.43) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL11038708 | 0.69 | TAAR1 (0.48) | TAAR1NR3C1NR3C2TSHRNPC1 | |
| SCHEMBL17301179 | 0.67 | MEN1 (0.45) | TAAR1NR3C1NR3C2TSHRNPC1 |
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-2019116325-A1 | TRICYCLIC COMPOUNDS AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | RICHTER GEDEON NYRT. (HU) | 2019-06-20 | — | — | WO | disclosed |