Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 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 | |
|---|---|---|---|---|
| SCHEMBL8059273 | 0.86 | CYP2C19 (0.41) | CYP2C19HPGDPOLBTDP1SMN1; SMN2 | |
| SCHEMBL8059180 | 0.77 | GRM2 (0.45) | POLBTAAR1 | |
| SCHEMBL7644315 | 0.72 | GRM2 (0.44) | TDP1SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL8059183 | 0.72 | CYP1A2 (0.47) | CYP2C19HPGDPOLBTDP1SMN1; SMN2 | |
| SCHEMBL8046600 | 0.72 | GRM2 (0.41) | POLBRAB9ATAAR1 | |
| SCHEMBL7633968 | 0.72 | KIF11 (0.43) | CYP2C19TDP1RAB9ANPC1LMNA | |
| SCHEMBL4341638 | 0.71 | RIPK1 (0.48) | CYP2C19HPGDPOLBTDP1SMN1; SMN2 | |
| SCHEMBL4473902 | 0.71 | RIPK1 (0.51) | CYP2C19HPGDPOLBTDP1SMN1; SMN2 | |
| SCHEMBL8059153 | 0.71 | GRM2 (0.40) | POLBRAB9ATAAR1 | |
| SCHEMBL7639980 | 0.71 | GAA (0.41) | CYP2C19RAB9ANPC1TSHR |
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-6046180-A | NAALADase inhibitors | GUILFORD PHARMACEUTICALS INC. (US) | 2000-04-04 | — | — | US | disclosed |