Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | FAAH | O00519 | 2/20 | 0.44 |
| ▸ | MGLL | Q99685 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9818023 | 1.00 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HTTKMT2APABPC1 | |
| SCHEMBL8021632 | 1.00 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HTTKMT2APABPC1 | |
| SCHEMBL31065448 | 1.00 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HTTKMT2APABPC1 | |
| SCHEMBL16039334 | 0.98 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2HTTKMT2APABPC1 | |
| SCHEMBL8072056 | 0.91 | KMT2A (0.52) | ALDH1A1SMN1; SMN2HTTKMT2APABPC1 | |
| SCHEMBL8071806 | 0.91 | KMT2A (0.52) | ALDH1A1SMN1; SMN2HTTKMT2APABPC1 | |
| SCHEMBL4375825 | 0.91 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2HTTKMT2APABPC1 | |
| SCHEMBL8829438 | 0.88 | MGLL (0.52) | ALDH1A1SMN1; SMN2HTTKMT2AMEN1 | |
| SCHEMBL8632299 | 0.88 | MGLL (0.52) | ALDH1A1SMN1; SMN2HTTKMT2AMEN1 | |
| SCHEMBL1982535 | 0.88 | MGLL (0.52) | ALDH1A1SMN1; SMN2HTTKMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6121270-A | N-(EPOXYALKYL)XANTHINE DERIVATIVES WHICH MODULATE CELLULAR RESPONSES TO NOXIOUS, PRO-INFLAMMATORY STIMULI | CELL THERAPEUTICS, INC. (US) | 2000-09-19 | — | — | US | disclosed |
| US-5866576-A | COMPOUNDS THAT ACT AS DRUGS ON THE CELLULAR AND BIOCHEMICAL LEVEL TO MODULATE CELLULAR RESPONSES TO NOXIOUS, PRO-INFLAMMATORY STIMULI. | CELL THERAPEUTICS, INC. (US) | 1999-02-02 | — | — | US | disclosed |