Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.48 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18929879 | 0.93 | L3MBTL1 (0.46) | L3MBTL1TDP1KCNA5KCNN4TRPV1 | |
| SCHEMBL10771297 | 0.84 | TRPV1 (0.48) | L3MBTL1TDP1KCNA5KCNN4TRPV1 | |
| SCHEMBL27463798 | 0.81 | KCNA5 (0.51) | L3MBTL1TDP1KCNA5KCNN4TRPV1 | |
| SCHEMBL17484099 | 0.81 | KCNA5 (0.48) | L3MBTL1TDP1KCNA5KCNN4TRPV1 | |
| SCHEMBL1432726 | 0.80 | NPSR1 (0.51) | L3MBTL1KCNA5KCNN4CYP3A4CYP2C19 | |
| SCHEMBL17059858 | 0.78 | KCNA5 (0.46) | L3MBTL1TDP1KCNA5KCNN4TRPV1 | |
| SCHEMBL11490914 | 0.77 | L3MBTL1 (0.49) | L3MBTL1TDP1KCNA5KCNN4TRPV1 | |
| SCHEMBL811561 | 0.76 | NR1H2 (0.50) | CYP3A4CYP2D6HTTMAPTMAPK1 | |
| SCHEMBL107013 | 0.76 | CNR2 (0.49) | TDP1LMNAPOLBMAPTNPSR1 | |
| SCHEMBL14229682 | 0.75 | TP53 (0.56) | L3MBTL1KCNA5KCNN4TRPV1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1354887-B1 | Ligands for metals and improved metal-catalyzed processes based thereon | MASSACHUSETTS INST TECHNOLOGY (US) | 2007-04-25 | — | — | EP | disclosed |
| EP-1097158-B1 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INST TECHNOLOGY (US) | 2006-01-25 | — | — | EP | disclosed |
| EP-1354887-A1 | Ligands for metals and improved metal-catalyzed processes based thereon | Massachusetts Insitute of Technology (US) | 2003-10-22 | — | — | EP | disclosed |