Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.57 |
| ▸ | NPC1 | O15118 | 6/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CASP3 | P42574 | 1/20 | 0.57 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.57 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.57 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.45 |
| ▸ | RELA | Q04206 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10697633 | 0.86 | RAB9A (0.69) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL27800721 | 0.83 | ALOX15 (0.54) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL24555308 | 0.81 | TP53 (0.49) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL11613440 | 0.81 | RAB9A (0.59) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL2939270 | 0.80 | NPC1 (0.75) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL24555364 | 0.79 | NPC1 (0.52) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL16851761 | 0.79 | NPC1 (0.51) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL18596655 | 0.79 | NPC1 (0.49) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL8076003 | 0.79 | SMN1; SMN2 (0.56) | RAB9ASMN1; SMN2NPC1LMNATP53 | |
| SCHEMBL15722690 | 0.78 | NPC1 (0.50) | RAB9ASMN1; SMN2NPC1LMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101959516-B | Combination therapy comprising quinoxaline PI3K alpha inhibitors for the treatment of cancer | EXELIXIS INC | 2013-05-08 | — | — | CN | disclosed |
| CN-101959516-A | Combination therapy comprising quinoxaline PI3K alpha inhibitors for the treatment of cancer | EXELIXIS INC | 2011-01-26 | — | — | CN | disclosed |