Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FOLH1 | Q04609 | 5/20 | 0.54 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 2/20 | 0.43 |
| ▸ | CTSK | P43235 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14551912 | 0.89 | S1PR3 (0.47) | FOLH1S1PR3CTSSCTSKTRPA1 | |
| SCHEMBL10725965 | 0.88 | YARS1 (0.47) | FOLH1CTSSCTSKACE | |
| SCHEMBL2839359 | 0.87 | S1PR3 (0.44) | FOLH1S1PR3CTSSCTSKTRPA1 | |
| SCHEMBL30468515 | 0.86 | S1PR3 (0.48) | FOLH1S1PR3CTSSCTSKTRPA1 | |
| SCHEMBL2835000 | 0.86 | S1PR3 (0.48) | FOLH1S1PR3CTSSCTSKTRPA1 | |
| SCHEMBL11353719 | 0.85 | CTSS (0.44) | FOLH1S1PR3CTSSCTSKGABRB1 | |
| SCHEMBL23414076 | 0.85 | CTSS (0.44) | FOLH1S1PR3CTSSCTSKTRPA1 | |
| SCHEMBL2836606 | 0.85 | S1PR3 (0.42) | FOLH1S1PR3CTSSCTSKTRPA1 | |
| SCHEMBL3375654 | 0.85 | AAK1 (0.46) | FOLH1S1PR3CTSSCTSKAAK1 | |
| SCHEMBL10815323 | 0.84 | S1PR3 (0.45) | FOLH1S1PR3CTSSCTSKACE |
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-4257947-A | INTERMEDIATES FOR ANTIBACTERIAL CEPHALOSPORINS | SMITHKLINE CORPORATION (US) | 1981-03-24 | — | — | US | disclosed |
| US-4166816-A | CYCLIZATION | SMITHKLINE CORPORATION (US) | 1979-09-04 | — | — | US | disclosed |
| US-4103086-A | 8-Oxo-4-thia-1-azabicyclo (4.2.0)-oct-2-ene derivatives | SMITHKLINE CORPORATION (US) | 1978-07-25 | — | — | US | disclosed |
| US-4072674-A | FOR CEPHALOSPORIN CONGENERS | SMITHKLINE CORPORATION (US) | 1978-02-07 | — | — | US | disclosed |