Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | KAT2B | Q92831 | 4/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL14326989 | 0.88 | TSHR (0.59) | TSHRKAT2BACHEPOLBHTT | |
| SCHEMBL12075852 | 0.84 | POLB (0.46) | TSHRKAT2BPOLBHTTALDH1A1 | |
| SCHEMBL12061436 | 0.80 | HTT (0.38) | TSHRKAT2BPOLBHTTALDH1A1 | |
| SCHEMBL16954443 | 0.80 | TSHR (0.61) | TSHRACHEPOLBHTTALDH1A1 | |
| SCHEMBL15787310 | 0.78 | MAOA (0.48) | TSHRALDH1A1MAOA | |
| SCHEMBL27959715 | 0.78 | TSHR (0.59) | TSHRACHEPOLBHTTALDH1A1 | |
| SCHEMBL13598125 | 0.75 | TSHR (0.65) | TSHRACHEPOLBHTTALDH1A1 | |
| SCHEMBL17277598 | 0.75 | TAAR1 (0.50) | MAOA | |
| SCHEMBL10748504 | 0.74 | TSHR (0.53) | TSHRACHEHTTALDH1A1HSD17B10 | |
| SCHEMBL10155626 | 0.74 | TSHR (0.63) | TSHRACHEPOLBHTTALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9193731-B2 | Antimicrobial compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2015-11-24 | — | — | US | disclosed |
| WO-2011047319-A2 | ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | RIB-X PHARMACEUTICALS, INC. (US) | 2011-04-21 | — | — | WO | disclosed |