Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2152818 | 0.80 | FBP1 (0.49) | ALDH1A1LMNAKDM4ETSHRCYP1A2 | |
| SCHEMBL15216490 | 0.77 | FBP1 (0.49) | ALDH1A1TDP1TSHRHSD17B10CYP1A2 | |
| SCHEMBL7922827 | 0.77 | FBP1 (0.49) | ALDH1A1TDP1TSHRHSD17B10CYP1A2 | |
| SCHEMBL6154484 | 0.76 | PTGS2 (0.51) | ALDH1A1MAPTSMN1; SMN2MAOBKMT2A | |
| SCHEMBL19084670 | 0.76 | ALDH1A3 (0.50) | ALDH1A1MAPTLMNASMN1; SMN2KMT2A | |
| SCHEMBL7926738 | 0.76 | ALDH1A1 (0.48) | ALDH1A1MAPTL3MBTL1TDP1TSHR | |
| SCHEMBL15216500 | 0.76 | ALDH1A1 (0.48) | ALDH1A1MAPTL3MBTL1TDP1TSHR | |
| SCHEMBL6637190 | 0.75 | ADORA2A (0.40) | ALDH1A1MAPTLMNASMN1; SMN2KMT2A | |
| SCHEMBL28552488 | 0.74 | FBP1 (0.44) | ALDH1A1SMN1; SMN2MAOBKMT2AL3MBTL1 | |
| SCHEMBL15216491 | 0.74 | FBP1 (0.44) | ALDH1A1SMN1; SMN2MAOBKMT2AL3MBTL1 |
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-6194461-B1 | USEFUL AS MEDICAMENT FOR TREATING RETINAL DEGENERATIVE DISORDERS; ALPHA-(2,4-DIFLUOROPHENYL)-N-T-BUTYLNITRONE, AND CORRESPONDING AMINES WHICH WOULD BE CONVERTED IN VIVO TO THE NITRONE, FOR EXAMPLE | SUMITOMO PHARMACEUTICALS CO., LTD. (JP) | 2001-02-27 | — | — | US | disclosed |
| EP-0945426-A1 | NITRONE DERIVATIVES | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1999-09-29 | — | — | EP | disclosed |