Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 3/20 | 0.36 |
| ▸ | MMP7 | P09237 | 3/20 | 0.36 |
| ▸ | MMP9 | P14780 | 3/20 | 0.36 |
| ▸ | MMP13 | P45452 | 3/20 | 0.36 |
| ▸ | MMP1 | P03956 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | MMP14 | P50281 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3743225 | 0.80 | CNR1 (0.37) | ALDH1A1MMP2MMP7MMP9MMP13 | |
| SCHEMBL3738015 | 0.80 | MLYCD (0.48) | ALDH1A1HPGDNLRP3L3MBTL1MAPT | |
| SCHEMBL3737791 | 0.78 | TRPV1 (0.44) | HPGD | |
| SCHEMBL3738515 | 0.77 | TRPV1 (0.47) | ALDH1A1HPGDKMT2A | |
| SCHEMBL3737636 | 0.76 | CA1 (0.42) | ALDH1A1HPGDKMT2AMAPTCA1 | |
| SCHEMBL3736646 | 0.75 | LMNA (0.41) | ALDH1A1HPGDKMT2AL3MBTL1MAPT | |
| SCHEMBL7594249 | 0.74 | PTPN1 (0.36) | ALDH1A1ATML3MBTL1 | |
| SCHEMBL3746413 | 0.74 | ALDH1A1 (0.44) | ALDH1A1MMP2MMP7MMP9MMP13 | |
| SCHEMBL3743393 | 0.73 | ALDH1A1 (0.47) | ALDH1A1HPGDKMT2AGAAMAPT | |
| SCHEMBL7598030 | 0.73 | PTPN1 (0.37) | ALDH1A1ATML3MBTL1 |
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-1812012-A2 | PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF | Ceptyr, Inc. (US) | 2007-08-01 | — | — | EP | disclosed |
| WO-2006055525-A2 | PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF | CEPTYR, INC. (US) | 2006-05-26 | — | — | WO | disclosed |