Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HKDC1 | Q2TB90 | 2/20 | 0.54 |
| ▸ | CCR6 | P51684 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL11577947 | 0.92 | CYP1A2 (0.53) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL23175329 | 0.86 | HKDC1 (0.47) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL27572489 | 0.81 | HKDC1 (0.48) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL15551466 | 0.81 | HKDC1 (0.47) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL28031782 | 0.81 | HKDC1 (0.50) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL9387839 | 0.81 | HKDC1 (0.60) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL9388858 | 0.80 | MAPT (0.60) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL27732024 | 0.80 | HKDC1 (0.51) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL7914952 | 0.77 | ALDH1A1 (0.53) | HKDC1CCR6CES1MAOAMAOB | |
| SCHEMBL10704950 | 0.77 | CCR6 (0.51) | HKDC1CCR6MAOAMAOBHSD17B3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050089890-A1 | Multimolecular devices and drug delivery systems | CUBICCIOTTI ROGER S (US) | 2005-04-28 | — | — | US | disclosed |
| US-6762025-B2 | SYNTHETIC NUCLEOTIDE SEQUENCES; GENERATE SEQUENCES, INCUBATE WITH PREFERENTIAL NUCLEOTIDE SEQUENCES, MONITOR SAMPLES FOR BINDING | MOLECULAR MACHINES, INC. | 2004-07-13 | — | — | US | disclosed |
| US-20020034757-A1 | Single-molecule selection methods and compositions therefrom | CUBICCIOTTI ROGER S (US) | 2002-03-21 | — | — | US | disclosed |
| US-6287765-B1 | SYNTHETIC HETEROPOLYMERS, OLIGONUCLEOTIDE MOLECULE CAPABLE OF SPECIFICALLY BINDING TO NONOLIGONUCLEOTIDE; TEMPLATE-DIRECTED MOLECULAR ASSEMBLY AND DEVICE INTEGRATION; DRUG DELIVERY SYSTEMS, SENSORS, SWITCHES, TRANSDUCERS | MOLECULAR MACHINES, INC. | 2001-09-11 | — | — | US | disclosed |
| US-5773635-A | ALDOL CONDENSATION; IN PRESENCE OF OXYGEN OR NITRIC OXIDE | BASF AKTIENGESELLSCHAFT (DE) | 1998-06-30 | — | — | US | disclosed |
| US-4482492-A | Preparation of vitamins K3 and K4 and derivatives | BASF AKTIENGESELLSCHAFT (DE) | 1984-11-13 | — | — | US | disclosed |