Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QPCT | Q16769 | 1/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.51 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.50 |
| ▸ | IP6K2 | Q9UHH9 | 3/20 | 0.49 |
| ▸ | FLT3 | P36888 | 3/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7773350 | 0.84 | MAOA (0.60) | CYP1B1CYP1A1MAOAAKR1B1MAPK8 | |
| SCHEMBL22680507 | 0.79 | ABCB1 (0.71) | QPCTCYP1B1CYP1A1FLT3ABCB1 | |
| SCHEMBL31237667 | 0.79 | ABCB1 (0.71) | QPCTCYP1B1CYP1A1FLT3ABCB1 | |
| SCHEMBL15245959 | 0.78 | FLT3 (0.74) | QPCTCYP1B1CYP1A1MAOAAKR1B1 | |
| SCHEMBL16894617 | 0.78 | ABCB1 (0.74) | CYP1B1CYP1A1FLT3ABCB1MAPT | |
| SCHEMBL3189297 | 0.78 | CYP1B1 (0.61) | QPCTCYP1B1CYP1A1MAOAAKR1B1 | |
| SCHEMBL24882669 | 0.78 | EGFR (0.78) | CYP1B1CYP1A1MAOAAKR1B1IP6K2 | |
| SCHEMBL1975844 | 0.76 | IP6K2 (0.66) | QPCTCYP1B1CYP1A1MAOAAKR1B1 | |
| Corymbosin SCHEMBL1976826 | 0.76 | ABCB1 (0.78) | CYP1B1CYP1A1MAOAAKR1B1MAPK8 | |
| Corymbosin SCHEMBL29426420 | 0.76 | ABCB1 (0.78) | CYP1B1CYP1A1MAOAAKR1B1MAPK8 |
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-2001007034-A1 | MULTIDRUG RESISTANCE PUMP INHIBITORS AND USES THEREOF | COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2001-02-01 | — | — | WO | disclosed |