Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | PKM | P14618 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.41 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.40 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.40 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.40 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18797621 | 0.83 | PKM (0.47) | ALDH1A1PKMKDM4EL3MBTL1CES2 | |
| SCHEMBL16549739 | 0.76 | PKM (0.55) | ALDH1A1PKMKDM4EL3MBTL1KAT6A | |
| SCHEMBL18797618 | 0.76 | POLB (0.48) | ALDH1A1PKMKDM4EL3MBTL1CES2 | |
| SCHEMBL34548 | 0.74 | KDM4E (0.50) | ALDH1A1PKMKDM4EL3MBTL1CES2 | |
| SCHEMBL29622864 | 0.74 | KDM4E (0.50) | ALDH1A1PKMKDM4EL3MBTL1CES2 | |
| SCHEMBL29569774 | 0.74 | KDM4E (0.50) | ALDH1A1PKMKDM4EL3MBTL1LMNA | |
| SCHEMBL323373 | 0.74 | KDM4E (0.50) | ALDH1A1PKMKDM4EL3MBTL1LMNA | |
| SCHEMBL29908261 | 0.74 | KDM4E (0.50) | ALDH1A1PKMKDM4EL3MBTL1LMNA | |
| SCHEMBL5238140 | 0.74 | KDM4E (0.50) | PKMKDM4EL3MBTL1CES2CES1 | |
| SCHEMBL1673906 | 0.73 | KDM4E (0.64) | PKMKDM4EL3MBTL1CES2CES1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050287594-A1 | Activity-based probes having specificity to the active form of enzymes and receptors; screening for desired biological activities or target proteins | SCRIPPS RESEARCH INSTITUTE, THE | 2005-12-29 | — | — | US | disclosed |
| US-6872574-B2 | Generating and screening compound libraries that are used for the identification of lead molecules, and for the parallel identification of their biological targets | THE SCRIPPS RESEARCH INSTITUTE (US) | 2005-03-29 | — | — | US | disclosed |
| EP-1275006-A2 | PROTEOMIC ANALYSIS USING ACTIVITY-BASED PROBE LIBRARIES | The Scripps Research Institute (US) | 2003-01-15 | — | — | EP | disclosed |
| US-20020182652-A1 | Proteomic analysis | NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR | 2002-12-05 | — | — | US | disclosed |
| US-20020064799-A1 | Proteomic analysis | THE SCRIPPS RESEARCH INSTITUTE OF AN ASSIGNMENT | 2002-05-30 | — | — | US | disclosed |
| US-20020045194-A1 | Proteomic analysis | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2002-04-18 | — | — | US | disclosed |
| US-20020040275-A1 | Proteomic analysis | THE SCRIPPS RESEARCH INSTITUTE | 2002-04-04 | — | — | US | disclosed |
| WO-2001077684-A2 | PROTEOMIC ANALYSIS USING ACTIVITY-BASED PROBE LIBRARIES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2001-10-18 | — | — | WO | disclosed |
| WO-2001077668-A2 | PROTEOMIC ANALYSIS USING ACTIVE-SITE DIRECTED PROBES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2001-10-18 | — | — | WO | disclosed |