Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA1 | P42261 | 3/20 | 0.46 |
| ▸ | CHRNA1 | P02708 | 3/20 | 0.45 |
| ▸ | CHRNG | P07510 | 3/20 | 0.45 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.45 |
| ▸ | CHRND | Q07001 | 3/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4866943 | 1.00 | GRIA1 (0.46) | GRIA1CHRNA1CHRNGCHRNB1CHRND | |
| SCHEMBL4864202 | 0.83 | KMT2A (0.49) | MMP8CYP2D6CYP2C9CYP2C19KMT2A | |
| SCHEMBL4864204 | 0.83 | KMT2A (0.49) | MMP8CYP2D6CYP2C9CYP2C19KMT2A | |
| SCHEMBL4866880 | 0.82 | KMT2A (0.45) | MMP8CYP2D6CYP2C9CYP2C19KMT2A | |
| SCHEMBL4866881 | 0.82 | KMT2A (0.45) | MMP8CYP2D6CYP2C9CYP2C19KMT2A | |
| SCHEMBL3740358 | 0.82 | PTPN1 (0.47) | GRIA1CHRNA1CHRNGCHRNB1CHRND | |
| SCHEMBL3740355 | 0.82 | PTPN1 (0.47) | GRIA1CHRNA1CHRNGCHRNB1CHRND | |
| SCHEMBL4866873 | 0.81 | TSHR (0.63) | CYP2C9CYP2C19KMT2A | |
| SCHEMBL4866876 | 0.81 | TSHR (0.63) | CYP2C9CYP2C19KMT2A | |
| SCHEMBL4858174 | 0.80 | MMP2 (0.56) | CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2008520575-A | — | — | 2008-06-19 | — | — | JP | claimed |
| EP-1812012-A2 | PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF | Ceptyr, Inc. (US) | 2007-08-01 | — | — | EP | claimed |
| WO-2006055525-A2 | PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF | CEPTYR, INC. (US) | 2006-05-26 | — | — | WO | claimed |