Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | ESRRG | P62508 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6017656 | 0.82 | NPC1 (0.52) | CYP2C19SIGMAR1HTT | |
| SCHEMBL8591090 | 0.79 | RAB9A (0.49) | CYP2C19PRSS1CTSGCTRB1CMA1 | |
| SCHEMBL9684810 | 0.77 | CYP2C19 (0.56) | KMT2AMEN1CYP2C19PRSS1CTSG | |
| SCHEMBL9684808 | 0.77 | CYP2C19 (0.56) | KMT2AMEN1CYP2C19PRSS1CTSG | |
| SCHEMBL8589794 | 0.76 | TP53BP1 (0.55) | KMT2AMEN1CYP2C19PRSS1CTSG | |
| SCHEMBL4352870 | 0.74 | KMT2A (0.55) | KMT2AMEN1TDP1TSHRHTT | |
| Iodohippurate SCHEMBL589803 | 0.73 | KMT2A (0.58) | KMT2AMEN1TDP1SIGMAR1ABL1 | |
| Iodohippurate SCHEMBL29959499 | 0.73 | KMT2A (0.58) | KMT2AMEN1TDP1SIGMAR1ABL1 | |
| SCHEMBL11319016 | 0.71 | KMT2A (0.69) | KMT2AMEN1TDP1CYP2C19 | |
| Iodohippurate SCHEMBL5915006 | 0.71 | KMT2A (0.56) | KMT2AMEN1TDP1SIGMAR1ABL1 |
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-1998049900-A1 | HALOISOQUINOLINE CARBOXAMIDE | EMORY UNIVERSITY (US) | 1998-11-12 | — | — | WO | disclosed |