Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10695957 | 0.86 | KDM4E (0.43) | CA2CA1TSHRHSP90AA1KDM4E | |
| SCHEMBL10814685 | 0.84 | MAPT (0.38) | CA2CA1HSD17B10TSHRKDM4E | |
| SCHEMBL11471018 | 0.83 | KMT2A (0.50) | CA2CA1NR1H4HSD17B10TSHR | |
| SCHEMBL28642071 | 0.81 | SOS1 (0.45) | HSD17B10TSHRMAPTHTTKMT2A | |
| SCHEMBL11528338 | 0.81 | NPC1 (0.49) | CA2ALDH1A1LMNAMAPTKMT2A | |
| SCHEMBL17242255 | 0.80 | MEN1 (0.53) | CA2CA1NR1H4HSD17B10TSHR | |
| SCHEMBL7391312 | 0.80 | BCL9 (0.49) | CA2CA1HSD17B10HSP90AA1HSP90AB1 | |
| SCHEMBL4789760 | 0.79 | MAPT (0.38) | NR1H4HSD17B10ESR2ESR1KDM4E | |
| SCHEMBL28964153 | 0.78 | ALDH1A1 (0.49) | CA2CA1HSD17B10KDM4ETHRB | |
| SCHEMBL4791444 | 0.77 | TSHR (0.50) | CA2CA1HSD17B10TSHRHSP90AA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0494733-A1 | Trifluoromethyl 1-carba(1-dethia)cephems | ELI LILLY AND COMPANY (US) | 1992-07-15 | — | — | EP | disclosed |
| US-5099015-A | Antibiotics formed by bromination of trifluoromethanesulfonyl containing cephalosporins | ELI LILLY AND COMPANY (US) | 1992-03-24 | — | — | US | disclosed |