Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | VCP | P55072 | 1/20 | 0.39 |
| ▸ | RHOA | P61586 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | PAM | P19021 | 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 | |
|---|---|---|---|---|
| SCHEMBL9865182 | 0.79 | CYP3A4 (0.49) | CYP3A4ALDH1A1TSHRHSD17B10PKM | |
| SCHEMBL852513 | 0.77 | GAA (0.50) | TSHRSMN1; SMN2NPSR1FFAR1VCP | |
| SCHEMBL9679306 | 0.76 | ALDH1A1 (0.52) | ALDH1A1NPSR1FFAR1NPC1RAB9A | |
| SCHEMBL761496 | 0.75 | CYP3A4 (0.43) | CYP3A4ALDH1A1TSHRHSD17B10PKM | |
| SCHEMBL27967652 | 0.75 | LMNA (0.51) | CYP3A4ALDH1A1TSHRSMN1; SMN2NPSR1 | |
| SCHEMBL18485606 | 0.74 | NPSR1 (0.50) | ALDH1A1NPSR1MAPTFFAR1VCP | |
| SCHEMBL777600 | 0.74 | NPSR1 (0.53) | ALDH1A1SMN1; SMN2NPSR1MAPTFFAR1 | |
| SCHEMBL6747784 | 0.73 | NPSR1 (0.46) | CYP3A4ALDH1A1NPSR1MAPTFFAR1 | |
| SCHEMBL5680676 | 0.73 | TSHR (0.53) | CYP3A4ALDH1A1TSHRHSD17B10SMN1; SMN2 | |
| SCHEMBL761495 | 0.72 | CYP3A4 (0.38) | CYP3A4ALDH1A1TSHRHSD17B10PKM |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5011938-A | Antimicrobials | ELI LILLY AND COMPANY (US) | 1991-04-30 | — | — | US | disclosed |
| US-4940718-A | BACTERICIDES | ELI LILLY AND COMPANY (US) | 1990-07-10 | — | — | US | disclosed |
| US-4902707-A | Bicyclic pyrazolidinones, compositions and use | ELI LILLY AND COMPANY (US) | 1990-02-20 | — | — | US | disclosed |
| EP-0203722-A1 | Bicyclic pyrazolidinones | ELI LILLY AND COMPANY (US) | 1986-12-03 | — | — | EP | disclosed |
| EP-0202046-A1 | 7-Substituted bicyclic pyrazolidinones | ELI LILLY AND COMPANY (US) | 1986-11-20 | — | — | EP | disclosed |
| CN-86103619-A | The preparation method of the bicyclic pyrazolidinones that 7-replaces | — | 1986-10-29 | — | — | CN | disclosed |