Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | CTSG | P08311 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1666338 | 0.87 | NR1H2 (0.38) | LIPGNR1H2NR1H3THRBTDP1 | |
| SCHEMBL28022595 | 0.87 | NR1H2 (0.38) | LIPGNR1H2NR1H3THRBTDP1 | |
| SCHEMBL266417 | 0.85 | LIPG (0.47) | LIPGNR1H2NR1H3THRBTDP1 | |
| SCHEMBL9800774 | 0.85 | NR1H2 (0.39) | LIPGNR1H2NR1H3THRBTDP1 | |
| SCHEMBL31734211 | 0.84 | LIPG (0.46) | LIPGNR1H2NR1H3THRBTDP1 | |
| SCHEMBL8612809 | 0.83 | MEN1 (0.48) | THRBTDP1MEN1LMNABLM | |
| SCHEMBL2701240 | 0.83 | LIPG (0.50) | LIPGNR1H2NR1H3CYP3A4CYP2D6 | |
| SCHEMBL1666533 | 0.83 | LIPG (0.44) | LIPGNR1H2NR1H3THRBTHRA | |
| SCHEMBL8505658 | 0.82 | LIPG (0.53) | LIPGNR1H2NR1H3THRBTDP1 | |
| SCHEMBL1666919 | 0.82 | LIPG (0.46) | LIPGNR1H2NR1H3THRBTHRA |
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-2011081651-A1 | METHODS AND COMPOSITIONS COMPRISING MACROCYCLES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2011-07-07 | — | — | WO | disclosed |