Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15730396 | 0.80 | RAB9A (0.49) | TSHRALDH1A1RAB9ASMN1; SMN2TDP1 | |
| SCHEMBL28320114 | 0.77 | RAB9A (0.55) | NOTUMEPHX2ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL15723872 | 0.77 | PTPN5 (0.42) | EPHX2ALDH1A1RAB9AKDM4EMEN1 | |
| SCHEMBL19199059 | 0.76 | NPC1 (0.64) | NOTUMCYP3A4CYP2C9CYP2C19TSHR | |
| SCHEMBL19198664 | 0.73 | NPC1 (0.64) | NOTUMIDO1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL31375610 | 0.71 | NPC1 (0.51) | TSHRALDH1A1RAB9ASMN1; SMN2TDP1 | |
| SCHEMBL31375504 | 0.71 | EPHX2 (0.42) | NOTUMEPHX2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL12444310 | 0.71 | BRD4 (0.48) | NOTUMEPHX2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4456071 | 0.70 | CYP3A4 (0.50) | IDO1CYP3A4CYP2C9CYP2C19TSHR | |
| SCHEMBL27594134 | 0.70 | ALDH1A1 (0.39) | NOTUMALDH1A1RAB9ASMN1; SMN2KDM4E |
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-2729448-B1 | COMPOUNDS FOR THE TREATMENT OF HIV | GILEAD SCIENCES INC (US) | 2015-09-09 | — | — | EP | disclosed |