Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 8/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 2/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | SETD2 | Q9BYW2 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4618611 | 0.85 | CTSA (0.40) | CTSAP2RX7SMN1; SMN2KMT2AFFAR1 | |
| SCHEMBL7798971 | 0.82 | CTSA (0.43) | CTSAHTTSMN1; SMN2KMT2AKDM4E | |
| SCHEMBL15173988 | 0.81 | CTSA (0.38) | CTSAP2RX7NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7797110 | 0.81 | SMN1; SMN2 (0.37) | SMN1; SMN2KMT2AKDM4ECYP1A2MAPT | |
| SCHEMBL176092 | 0.79 | P2RX7 (0.46) | CTSAP2RX7FFAR1 | |
| SCHEMBL16151353 | 0.77 | KMT2A (0.40) | P2RX7SMN1; SMN2KMT2AKDM4ECYP1A2 | |
| SCHEMBL11196152 | 0.76 | NOS3 (0.48) | NOS3NOS1NOS2NPC1RAB9A | |
| SCHEMBL17616530 | 0.75 | SCN4A (0.46) | NOS3NOS1NOS2CYP1A2 | |
| SCHEMBL5456877 | 0.74 | NPC1 (0.42) | NOS3NOS1NOS2NPC1HTT | |
| SCHEMBL2320843 | 0.74 | CTSA (0.47) | CTSA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1362948-A | Preparation method of 3S-3-amino-3-aryl propionic acid and derivatives thereof | ORTHO MCNEIL PHARM INC (US) | 2002-08-07 | — | — | CN | disclosed |
| EP-1163222-A1 | PROCESS OF PREPARING 3S-3-AMINO-3-ARYL PROPIONIC ACID AND DERIVATIVES THEREOF | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000056715-A1 | PROCESS OF PREPARING 3S-3-AMINO-3-ARYL PROPIONIC ACID AND DERIVATIVES THEREOF | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2000-09-28 | — | — | WO | disclosed |