Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | RGS12 | O14924 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | THPO | P40225 | 1/20 | 0.53 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL5700232 | 0.89 | CHRM2 (0.61) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL5709299 | 0.89 | CHRM2 (0.61) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL9299531 | 0.89 | CHRM2 (0.61) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL8470500 | 0.84 | ALDH1A1 (0.50) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL5643762 | 0.83 | ALDH1A1 (0.71) | CYP2D6CYP2C9PKMHSD17B10KMT2A | |
| SCHEMBL8470928 | 0.79 | KMT2A (0.49) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL30695641 | 0.79 | UTS2R (0.54) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL16164987 | 0.77 | ADRA2C (0.62) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL14393865 | 0.75 | ADRA2C (0.60) | CHRM2ADRA1ARGS12GLACYP3A4 | |
| SCHEMBL4407404 | 0.75 | ADRA2C (0.60) | CHRM2ADRA1ARGS12GLACYP3A4 |
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-5998624-A | MEDICAL DIAGNOSIS; BINDING TO SITE OF INJURY, INFLAMMATION | EMORY UNIVERSITY (US) | 1999-12-07 | — | — | US | disclosed |
| WO-1998049900-A1 | HALOISOQUINOLINE CARBOXAMIDE | EMORY UNIVERSITY (US) | 1998-11-12 | — | — | WO | disclosed |