Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | GRN | P28799 | 1/20 | 0.46 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.44 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8255500 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNACTSKKMT2AFOLH1 | |
| SCHEMBL17833228 | 0.85 | PSMB5 (0.57) | ALDH1A1LMNACTSKKMT2APSMB5 | |
| SCHEMBL3451636 | 0.85 | PSMB5 (0.57) | ALDH1A1LMNACTSKKMT2APSMB5 | |
| SCHEMBL3451593 | 0.85 | PSMB5 (0.57) | ALDH1A1LMNACTSKKMT2APSMB5 | |
| SCHEMBL5172068 | 0.84 | MME (0.56) | ALDH1A1LMNACTSKMMP1MMP3 | |
| SCHEMBL27723663 | 0.84 | ITGB1 (0.55) | ALDH1A1LMNACTSKFOLH1GRN | |
| SCHEMBL27723661 | 0.84 | ITGB1 (0.55) | ALDH1A1LMNACTSKFOLH1GRN | |
| SCHEMBL560722 | 0.84 | FPR2 (0.57) | ALDH1A1LMNACTSKFOLH1GRN | |
| SCHEMBL560721 | 0.84 | FPR2 (0.57) | ALDH1A1LMNACTSKFOLH1GRN | |
| SCHEMBL4703394 | 0.84 | CTSK (0.69) | ALDH1A1LMNACTSKFOLH1MMP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7045532-B2 | ACE-2 modulating compounds and methods of use thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2006-05-16 | — | — | US | disclosed |
| US-6632830-B1 | Blood pressure related disease or disorder, cell proliferation disorder, kidney disorder, kinetensin associated disorder, inflammation associated disorder, or an allergic disorder | MILLENNIUM PHARMACEUTICALS, INC. | 2003-10-14 | — | — | US | disclosed |