Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.66 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | TET3 | O43151 | 1/20 | 0.54 |
| ▸ | FBXL19 | Q6PCT2 | 1/20 | 0.54 |
| ▸ | CXXC5 | Q7LFL8 | 1/20 | 0.54 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.54 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.54 |
| ▸ | CXXC4 | Q9H2H0 | 1/20 | 0.54 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12987942 | 0.86 | KMT2A (0.54) | KMT2ACYP2C19MEN1RAB9AAKR1C1 | |
| SCHEMBL6498727 | 0.86 | KMT2A (0.68) | KMT2ACYP2C19MEN1RAB9AAKR1C1 | |
| SCHEMBL2701337 | 0.85 | KMT2A (0.72) | KMT2ACYP2C19MEN1RAB9AAKR1C1 | |
| SCHEMBL6502637 | 0.80 | KMT2A (0.61) | KMT2ACYP2C19MEN1RAB9AAKR1C1 | |
| SCHEMBL3046108 | 0.80 | OPRM1 (0.65) | KMT2ACYP2C19MEN1RAB9AAKR1C1 | |
| Hydrochloric Acid SCHEMBL3396780 | 0.78 | OPRM1 (0.66) | KMT2ACYP2C19MEN1RAB9AAKR1C1 | |
| SCHEMBL10282914 | 0.77 | CYP2C9 (0.55) | KMT2ACYP2C19MEN1TSHRSMN1; SMN2 | |
| SCHEMBL2699791 | 0.77 | KMT2A (0.76) | KMT2ACYP2C19MEN1RAB9ATSHR | |
| SCHEMBL31016196 | 0.76 | AKR1C1 (0.83) | KMT2ACYP2C19MEN1RAB9AAKR1C1 | |
| SCHEMBL6391 | 0.76 | AKR1C1 (0.83) | KMT2ACYP2C19MEN1RAB9AAKR1C1 |
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-2003037271-A2 | COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREFOR | MILLENNIUM PHARMACEUTICALS,INC. (US) | 2003-05-08 | — | — | WO | disclosed |