Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 8/20 | 0.43 |
| ▸ | MEN1 | O00255 | 6/20 | 0.43 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9102033 | 0.92 | LCLAT1 (0.42) | KMT2AMEN1DDR2KDRHSD17B10 | |
| SCHEMBL9100020 | 0.89 | RAF1 (0.55) | DDR2KDRRAF1MAPTMAPK1 | |
| SCHEMBL4474065 | 0.88 | DDR2 (0.55) | KMT2AMEN1DDR2KDRRAF1 | |
| SCHEMBL9102011 | 0.87 | KDR (0.49) | KDRRAF1HPGDKDM4ELMNA | |
| SCHEMBL9102036 | 0.83 | MAPT (0.41) | KMT2AMEN1KDRHSD17B10MAPT | |
| SCHEMBL9104786 | 0.81 | RAF1 (0.49) | KDRRAF1MAPTMAPK1KDM4E | |
| SCHEMBL9103055 | 0.81 | LMNA (0.44) | KMT2AMEN1KDRRAF1HSD17B10 | |
| SCHEMBL9103895 | 0.81 | KDR (0.37) | DDR2KDRMAPTHPGDMAPK1 | |
| SCHEMBL9105444 | 0.80 | KDR (0.45) | KMT2AMEN1DDR2KDRRAF1 | |
| SCHEMBL4473374 | 0.80 | DDR2 (0.54) | KMT2AMEN1DDR2KDRRAF1 |
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-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | claimed |
| EP-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | disclosed |