Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.61 |
| ▸ | CTSS | P25774 | 5/20 | 0.59 |
| ▸ | CTSK | P43235 | 4/20 | 0.59 |
| ▸ | CTSB | P07858 | 2/20 | 0.59 |
| ▸ | CTSL | P07711 | 1/20 | 0.59 |
| ▸ | ACE | P12821 | 1/20 | 0.56 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.52 |
| ▸ | PPARA | Q07869 | 2/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.51 |
| ▸ | AKT1 | P31749 | 1/20 | 0.51 |
| ▸ | APP | P05067 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | XBP1 | P17861 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7349815 | 1.00 | ATM (0.61) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL27759656 | 0.87 | CTSS (0.58) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL20397779 | 0.85 | PPARG (0.51) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL7425280 | 0.84 | KLK5 (0.61) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL20397698 | 0.84 | PPARG (0.52) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL6832510 | 0.84 | KLK5 (0.61) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL7939304 | 0.83 | ATM (0.63) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL3676166 | 0.83 | NPC1 (0.63) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL12203694 | 0.83 | NPC1 (0.63) | ATMCTSSCTSKCTSBCTSL | |
| SCHEMBL3676162 | 0.83 | NPC1 (0.63) | ATMCTSSCTSKCTSBCTSL |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117486762-A | Novel compound and use method and application thereof | 中国医学科学院医药生物技术研究所 | 2024-02-02 | — | — | CN | disclosed |
| EP-2809646-A1 | METHODS AND INTERMEDIATES FOR PREPARING PHARMACEUTICAL AGENTS | Gilead Sciences, Inc. (US) | 2014-12-10 | — | — | EP | disclosed |
| WO-2013116715-A1 | METHODS AND INTERMEDIATES FOR PREPARING PHARMACEUTICAL AGENTS | GILEAD SCIENCES, INC. (US) | 2013-08-08 | — | — | WO | disclosed |
| US-5190974-A | Analgesics | ROUSSEL UCLAF (FR) | 1993-03-02 | — | — | US | disclosed |
| CN-1049165-A | The cycloalkyl that N-replaces and the tryptophane-phenylalanine of multi-ring alkyl alpha-substitution-and phenylethylamine derivative | WARNER LAMBERT CO (US) | 1991-02-13 | — | — | CN | disclosed |