Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | RAB9A | P51151 | 6/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.47 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.47 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6899961 | 0.87 | RAB9A (0.63) | ALDH1A1RAB9ASMN1; SMN2NPC1MEN1 | |
| Hydrochloric Acid SCHEMBL4139825 | 0.86 | RAB9A (0.48) | ALDH1A1RAB9ASMN1; SMN2NPC1TLR9 | |
| SCHEMBL15186353 | 0.82 | SPHK1 (0.58) | — | |
| Hydrochloric Acid SCHEMBL15175881 | 0.81 | SPHK1 (0.58) | — | |
| Hydrochloric Acid SCHEMBL15175878 | 0.81 | SPHK1 (0.58) | — | |
| SCHEMBL22280440 | 0.80 | ALDH1A1 (0.55) | ALDH1A1RAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL22280458 | 0.77 | ALDH1A1 (0.54) | ALDH1A1RAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL22280454 | 0.77 | ALDH1A1 (0.54) | ALDH1A1RAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL22280284 | 0.76 | ALDH1A1 (0.55) | ALDH1A1RAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL8272732 | 0.75 | NR1H4 (0.67) | ALDH1A1RAB9ASMN1; SMN2NPC1TSHR |
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-9688668-B2 | Long chain base sphingosine kinase inhibitors | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2017-06-27 | — | — | US | disclosed |