Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | RAF1 | P04049 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29173244 | 0.82 | CYP11B2 (0.57) | S1PR1CYP11B2RAF1CYP2C19NOTUM | |
| SCHEMBL24556967 | 0.82 | CYP11B2 (0.57) | S1PR1CYP11B2RAF1CYP2C19NOTUM | |
| SCHEMBL24602720 | 0.82 | CYP11B2 (0.57) | S1PR1CYP11B2RAF1CYP2C19NOTUM | |
| SCHEMBL24556963 | 0.82 | CYP11B2 (0.57) | S1PR1CYP11B2RAF1CYP2C19NOTUM | |
| SCHEMBL60634 | 0.82 | CYP11B2 (0.57) | S1PR1CYP11B2RAF1CYP2C19NOTUM | |
| SCHEMBL10476961 | 0.81 | APP (0.48) | CYP11B2LMNASMN1; SMN2KDM4EKMT2A | |
| SCHEMBL6419399 | 0.80 | CYP11B2 (0.54) | S1PR1CYP11B2RAF1CYP2C19NOTUM | |
| SCHEMBL23918346 | 0.79 | FFAR1 (0.46) | S1PR1CYP11B2NOTUMHTTLMNA | |
| SCHEMBL23918344 | 0.79 | FFAR1 (0.46) | HTTLMNAKDM4EFFAR1HAO1 | |
| SCHEMBL31621355 | 0.79 | S1PR1 (0.64) | S1PR1CYP11B2RAF1CYP2C19NOTUM |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210318231-A1 | Liquid Crystal-Based Detection of Air Contaminants Using Metal Surfaces | NATIONAL SCIENCE FOUNDATION | 2021-10-14 | — | — | US | disclosed |