Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSPO | P30536 | 7/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TACR3 | P29371 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL8470604 | 0.75 | TSPO (0.56) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL29424334 | 0.71 | TSPO (1.00) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8473060 | 0.71 | TSPO (0.79) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8474388 | 0.70 | TSPO (0.65) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8474804 | 0.70 | TSPO (0.65) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8523967 | 0.70 | TSPO (0.61) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8470659 | 0.69 | TSPO (0.59) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8470920 | 0.69 | TSPO (0.64) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8523965 | 0.68 | TSPO (0.67) | TSPOMEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL8470616 | 0.67 | TSPO (0.60) | TSPOMEN1KMT2AALDH1A1CYP3A4 |
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 |