Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 3/20 | 0.42 |
| ▸ | HTR1B | P28222 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | RBP4 | P02753 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4932179 | 0.85 | PTPN11 (0.52) | MAPTRBP4ALDH1A1KDM4ESMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4931665 | 0.83 | POLB (0.46) | TP53MAPTRPS6KB1AKT1HTR1D | |
| SCHEMBL2301569 | 0.75 | AKT1 (0.59) | RPS6KB1AKT1P2RY12 | |
| SCHEMBL2454605 | 0.70 | MAPT (0.68) | NPC1RAB9ATP53MAPTSMN1; SMN2 | |
| SCHEMBL12644447 | 0.68 | HSPD1 (0.64) | TP53MAPTALDH1A1KMT2APLG | |
| SCHEMBL10245047 | 0.67 | KDM4E (0.65) | MAPTRBP4ALDH1A1KDM4EHPGD | |
| SCHEMBL14043612 | 0.67 | NPC1 (0.75) | NPC1RAB9ATP53MAPTCNR1 | |
| SCHEMBL2911616 | 0.65 | HDAC2 (0.71) | NPC1RAB9AKDM4EHPGDPOLB | |
| SCHEMBL11589882 | 0.65 | HSPD1 (0.64) | TP53MAPTALDH1A1KMT2APLG | |
| SCHEMBL19382960 | 0.65 | L3MBTL1 (0.60) | NPC1RAB9AMAPTPOLBSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1750727-A2 | KINASE MODULATORS AND METHODS OF USE | Exelixis, Inc. (US) | 2007-02-14 | — | — | EP | disclosed |
| WO-2005117909-A2 | KINASE MODULATORS AND METHODS OF USE | EXELIXIS, INC. (US) | 2005-12-15 | — | — | WO | disclosed |