Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | AGXT | P21549 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.33 |
| ▸ | KCNK5 | O95279 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
| ▸ | KCNK17 | Q96T54 | 1/20 | 0.33 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7920998 | 0.81 | IDO1 (0.40) | IDO1AGXTKDM4ESMN1; SMN2RIPK1 | |
| SCHEMBL7922884 | 0.80 | IDO1 (0.48) | IDO1AGXTKDM4ESMN1; SMN2RIPK1 | |
| SCHEMBL26530446 | 0.73 | IDO1 (0.46) | IDO1AGXTKDM4ESMN1; SMN2GAA | |
| SCHEMBL6077476 | 0.73 | IDO1 (0.48) | IDO1AGXTKDM4ESMN1; SMN2GAA | |
| SCHEMBL9074382 | 0.72 | RIPK1 (0.43) | IDO1AGXTKDM4ESMN1; SMN2RIPK1 | |
| SCHEMBL7922784 | 0.72 | IDO1 (0.41) | IDO1AGXTKDM4ESMN1; SMN2RIPK1 | |
| SCHEMBL2095744 | 0.70 | SLC6A4 (0.49) | IDO1AGXTKDM4ESMN1; SMN2GAA | |
| SCHEMBL706473 | 0.70 | IDO1 (0.64) | IDO1AGXTKDM4ESMN1; SMN2RIPK1 | |
| SCHEMBL19121691 | 0.69 | RIPK1 (0.47) | KDM4ESMN1; SMN2RIPK1 | |
| SCHEMBL6415999 | 0.69 | CES2 (0.45) | SMN1; SMN2GAAALDH1A1 |
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 |