Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 11/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 11/20 | 0.42 |
| ▸ | FABP4 | P15090 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
| ▸ | CDC42 | P60953 | 1/20 | 0.38 |
| ▸ | RAC1 | P63000 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 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 | |
|---|---|---|---|---|
| SCHEMBL11256125 | 0.74 | NOD1 (0.42) | SMN1; SMN2AKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL11244587 | 0.71 | NOD1 (0.61) | AKR1C3AKR1C2PTGS2PTGS1TSHR | |
| SCHEMBL11245114 | 0.68 | TP53 (0.39) | SMN1; SMN2AKR1C3AKR1C2PTGS2PTGS1 | |
| SCHEMBL16831706 | 0.64 | HCAR3 (0.60) | SMN1; SMN2 | |
| SCHEMBL10913232 | 0.64 | CA2 (0.58) | AKR1C3AKR1C2 | |
| SCHEMBL30564459 | 0.61 | AKR1C3 (0.60) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL59197 | 0.61 | PTGS2 (0.74) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL3680291 | 0.61 | AKR1C3 (0.57) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL10041460 | 0.61 | AKR1C3 (0.65) | AKR1C3AKR1C2PTGS2PTGS1CDC42 | |
| SCHEMBL2600793 | 0.61 | AKR1C3 (0.65) | AKR1C3AKR1C2PTGS2PTGS1CDC42 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4316021-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1982-02-16 | — | — | US | disclosed |
| US-4243813-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1981-01-06 | — | — | US | disclosed |
| US-4196125-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1980-04-01 | — | — | US | disclosed |
| US-4018790-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1977-04-19 | — | — | US | disclosed |