Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL11297486 | 0.85 | ALDH1A1 (0.43) | PDK2KMT2AALDH1A1TSHRTDP1 | |
| SCHEMBL5666601 | 0.79 | TSHR (0.61) | PDK2KMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL13451780 | 0.78 | PDK2 (0.45) | PDK2KMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL28738497 | 0.78 | MYC (0.52) | PDK2KMT2AMEN1ALDH1A1TDP1 | |
| SCHEMBL28172418 | 0.78 | CTSD (0.47) | KMT2AMEN1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL27645716 | 0.77 | CA2 (0.55) | PDK2ALDH1A1TSHRTDP1HSP90AB1 | |
| SCHEMBL6518446 | 0.77 | CDK4 (0.46) | PDK2KMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL9538711 | 0.77 | HSP90AB1 (0.47) | PDK2KMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL28523326 | 0.77 | PDK2 (0.41) | PDK2KMT2AMEN1ALDH1A1TSHR | |
| SCHEMBL28116443 | 0.77 | PDK2 (0.44) | PDK2KMT2AMEN1TSHRSMN1; SMN2 |
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-1097158-A2 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2001-05-09 | — | — | EP | disclosed |
| WO-2000002887-A2 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2000-01-20 | — | — | WO | disclosed |