Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 4/20 | 0.37 |
| ▸ | THRB | P10828 | 4/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 3/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28022174 | 0.98 | SMPD1 (0.39) | THRATHRBSMPD1TLR8PTPN11 | |
| SCHEMBL27946789 | 0.98 | SMPD1 (0.39) | THRATHRBSMPD1TLR8PTPN11 | |
| SCHEMBL13876361 | 0.98 | SMPD1 (0.39) | THRATHRBSMPD1TLR8PTPN11 | |
| SCHEMBL31464878 | 0.98 | SMPD1 (0.39) | THRATHRBSMPD1TLR8PTPN11 | |
| SCHEMBL4187002 | 0.98 | SMPD1 (0.39) | THRATHRBSMPD1TLR8PTPN11 | |
| SCHEMBL14842725 | 0.86 | RARB (0.35) | THRATHRBSMN1; SMN2TLR8MEN1 | |
| SCHEMBL14854547 | 0.86 | RARB (0.38) | SMN1; SMN2MEN1LMNACYP3A4MAPT | |
| SCHEMBL2417770 | 0.84 | SMPD1 (0.39) | THRATHRBSMPD1TLR8PTPN11 | |
| SCHEMBL13876373 | 0.79 | NCF1 (0.36) | SMN1; SMN2LMNAMAPT | |
| SCHEMBL28397542 | 0.77 | SMPD1 (0.38) | THRATHRBSMPD1PTPN11S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20180047906-A1 | HEXABENZOCORONENE-BASED COMPOUND FOR ORGANIC PHOTOVOLTAIC CELLS | UNIVERSITE DE PAU ET DES PAYS DE L'ADOUR (FR) | 2018-02-15 | — | — | US | disclosed |