Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | NOS3 | P29474 | 2/20 | 0.41 |
| ▸ | NOS1 | P29475 | 2/20 | 0.41 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23716379 | 0.80 | IDO1 (0.38) | CYP2A6IDO1CTBP2MAPK8NPC1 | |
| SCHEMBL23716034 | 0.80 | IDO1 (0.38) | IDO1CTBP2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL23715862 | 0.73 | IDO1 (0.41) | IDO1KMT2ATSHR | |
| SCHEMBL23716227 | 0.72 | GABRA1 (0.40) | IDO1NPC1RAB9ASMN1; SMN2L3MBTL1 | |
| SCHEMBL6616686 | 0.72 | CYP2A6 (0.58) | LOXL2CYP2A6IDO1NOS3NOS1 | |
| SCHEMBL23715869 | 0.71 | SMN1; SMN2 (0.33) | IDO1SMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL23716112 | 0.71 | PIK3CA (0.43) | IDO1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL23716287 | 0.70 | ANO1 (0.34) | — | |
| SCHEMBL2701963 | 0.69 | IDO1 (0.61) | LOXL2CYP2A6IDO1NOS3NOS1 | |
| SCHEMBL4703302 | 0.69 | CA2 (0.57) | LOXL2CYP2A6IDO1CTBP2MAPK8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3209732-B1 | SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS | SCRIPPS RESEARCH INST (US) | 2021-08-04 | — | — | EP | disclosed |