Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | MMP2 | P08253 | 3/20 | 0.45 |
| ▸ | MMP9 | P14780 | 3/20 | 0.45 |
| ▸ | MMP12 | P39900 | 3/20 | 0.45 |
| ▸ | MMP1 | P03956 | 2/20 | 0.45 |
| ▸ | GCGR | P47871 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1330921 | 0.80 | CASP3 (0.51) | POLBKMT2ALMNANPC1MAPT | |
| SCHEMBL7276461 | 0.80 | KDM4E (0.63) | ALDH1A1KMT2ASMN1; SMN2NPSR1TSHR | |
| SCHEMBL27708821 | 0.79 | P2RX7 (0.49) | ALDH1A1MMP2MMP9MMP12MMP1 | |
| SCHEMBL6057150 | 0.75 | ALDH1A1 (0.69) | ALDH1A1POLBTDP1SLC6A2SLC6A3 | |
| SCHEMBL4132618 | 0.72 | ALDH1A1 (0.64) | ALDH1A1POLBTDP1GCGRSLC6A2 | |
| SCHEMBL24308561 | 0.71 | ALDH1A1 (0.63) | ALDH1A1POLBTDP1MMP2MMP9 | |
| SCHEMBL7946864 | 0.71 | ALDH1A1 (0.73) | ALDH1A1POLBTDP1SLC6A2SLC6A3 | |
| SCHEMBL20020423 | 0.71 | ALDH1A1 (0.58) | ALDH1A1POLBTDP1MMP2MMP9 | |
| SCHEMBL11099441 | 0.70 | KMT2A (0.63) | ALDH1A1POLBTDP1SLC6A2SLC6A3 | |
| SCHEMBL19500815 | 0.70 | ALDH1A1 (0.55) | ALDH1A1POLBTDP1MMP2MMP9 |
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-0509769-B1 | Heterocyclic amides having HLE inhibiting activity | ZENECA LTD (GB) | 1996-09-11 | — | — | EP | disclosed |
| US-5521179-A | Heterocyclic amides | ZENECA LIMITED (GB) | 1996-05-28 | — | — | US | disclosed |
| EP-0509769-A2 | Heterocyclic amides having HLE inhibiting activity | ZENECA LIMITED (GB) | 1992-10-21 | — | — | EP | disclosed |