Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 18/20 | 0.60 |
| ▸ | MEN1 | O00255 | 15/20 | 0.60 |
| ▸ | MAPT | P10636 | 14/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.60 |
| ▸ | HPGD | P15428 | 4/20 | 0.60 |
| ▸ | POLB | P06746 | 4/20 | 0.60 |
| ▸ | NPC1 | O15118 | 8/20 | 0.58 |
| ▸ | RAB9A | P51151 | 7/20 | 0.58 |
| ▸ | HTT | P42858 | 4/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 8/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL4458660 | 0.84 | KMT2A (0.56) | KMT2AMEN1MAPTALDH1A1HPGD | |
| Acetic Acid SCHEMBL4458652 | 0.84 | KMT2A (0.56) | KMT2AMEN1MAPTALDH1A1HPGD | |
| Acetic Acid SCHEMBL4458658 | 0.84 | KMT2A (0.56) | KMT2AMEN1MAPTALDH1A1HPGD | |
| SCHEMBL28433359 | 0.82 | KMT2A (0.61) | KMT2AMEN1MAPTALDH1A1HPGD | |
| SCHEMBL28433360 | 0.82 | KMT2A (0.61) | KMT2AMEN1MAPTALDH1A1HPGD | |
| SCHEMBL15078624 | 0.76 | KMT2A (0.65) | KMT2AMEN1MAPTALDH1A1HPGD | |
| SCHEMBL14681431 | 0.75 | KMT2A (1.00) | KMT2AMEN1MAPTALDH1A1HPGD | |
| SCHEMBL31649237 | 0.74 | NPC1 (0.58) | KMT2AMEN1MAPTALDH1A1POLB | |
| SCHEMBL28424937 | 0.73 | KMT2A (0.44) | KMT2AMEN1MAPTALDH1A1HPGD | |
| SCHEMBL28424936 | 0.73 | KMT2A (0.44) | KMT2AMEN1MAPTALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009140215-A2 | METHOD FOR TREATING DRUG-RESISTANT BACTERIAL AND OTHER INFECTIONS WITH CLIOQUINOL, PHANQUINONE, AND RELATED COMPOUNDS | GERAGHTY, ERIN (US) | 2009-11-19 | — | — | WO | claimed |
| WO-2009140215-A2 | METHOD FOR TREATING DRUG-RESISTANT BACTERIAL AND OTHER INFECTIONS WITH CLIOQUINOL, PHANQUINONE, AND RELATED COMPOUNDS | GERAGHTY, ERIN (US) | 2009-11-19 | — | — | WO | disclosed |