Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.51 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.49 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12984806 | 1.00 | PTGS2 (0.51) | PTGS2KMT2AEPHX2PSMB5KDM4E | |
| SCHEMBL8130992 | 0.86 | KDM4E (0.52) | KMT2AEPHX2PSMB5KDM4ESMN1; SMN2 | |
| SCHEMBL8861463 | 0.86 | EPHX2 (0.50) | PTGS2KMT2AEPHX2PSMB5KDM4E | |
| SCHEMBL27883399 | 0.86 | EPHX2 (0.50) | PTGS2KMT2AEPHX2PSMB5KDM4E | |
| SCHEMBL31445160 | 0.86 | KDM4E (0.52) | KMT2AEPHX2PSMB5KDM4ESMN1; SMN2 | |
| SCHEMBL2327130 | 0.85 | PTGS2 (0.50) | PTGS2KMT2AEPHX2PSMB5KDM4E | |
| SCHEMBL2327136 | 0.85 | PTGS2 (0.50) | PTGS2KMT2AEPHX2PSMB5KDM4E | |
| SCHEMBL21623659 | 0.85 | PSMB5 (0.62) | PSMB5KDM4ESMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL9554481 | 0.85 | PSMB5 (0.62) | PSMB5KDM4ESMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL8013304 | 0.85 | PSMB5 (0.59) | PSMB5L3MBTL1USP30 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102807600-A | Amino acid modified spinacin derivative and preparation method and application thereof | UNIV CAPITAL MEDICAL | 2012-12-05 | — | — | CN | disclosed |