Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL11628857 | 0.83 | ALDH1A1 (0.48) | ALDH1A1HSD17B10TSHRCYP3A4THRA | |
| SCHEMBL8228724 | 0.83 | FAAH (0.54) | FAAHALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL823910 | 0.81 | MAOB (0.44) | ALDH1A1TSHRTDP1CYP3A4THRA | |
| SCHEMBL8115491 | 0.81 | TDP1 (0.45) | ALDH1A1HSD17B10TSHRTDP1CYP3A4 | |
| SCHEMBL8112886 | 0.80 | RAB9A (0.48) | ALDH1A1TSHRKDM4EMAOBMAOA | |
| SCHEMBL8116474 | 0.78 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TSHRCYP3A4NPSR1 | |
| SCHEMBL15152717 | 0.76 | THRA (0.51) | ALDH1A1TDP1THRATHRBMAOB | |
| SCHEMBL6746646 | 0.75 | THRA (0.44) | ALDH1A1TDP1THRATHRBMAOB | |
| SCHEMBL6999007 | 0.72 | CASP1 (0.46) | FAAHALDH1A1HSD17B10TSHRMAOB | |
| SCHEMBL366865 | 0.72 | MAOB (0.56) | ALDH1A1TSHRTDP1CYP3A4THRA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0590885-B1 | Antibiotic carbapenem compounds | ZENECA LTD (GB) | 2000-03-15 | — | — | EP | disclosed |
| US-5527791-A | Carbapenem antibiotic compounds | ZENECA LIMITED (GB) | 1996-06-18 | — | — | US | disclosed |
| EP-0590885-A1 | Antibiotic carbapenem compounds | ZENECA LIMITED (GB) | 1994-04-06 | — | — | EP | disclosed |