Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 8/20 | 0.50 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.46 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 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 | |
|---|---|---|---|---|
| SCHEMBL7008205 | 0.79 | CYP1A2 (0.54) | KDM4EHPGDNPC1MAPTSMN1; SMN2 | |
| SCHEMBL26664855 | 0.73 | HPGD (0.51) | KDM4EHPGDNPC1MAPTSMN1; SMN2 | |
| SCHEMBL1061379 | 0.72 | KDM4E (0.64) | KDM4ERAB9AMAPTSMN1; SMN2CSF1R | |
| SCHEMBL16972721 | 0.68 | TP53 (0.56) | KDM4EHPGDNPC1RAB9AMAPT | |
| SCHEMBL4696686 | 0.68 | CSF1R (0.61) | KDM4EHPGDMAPTSMN1; SMN2CSF1R | |
| SCHEMBL17952494 | 0.68 | ALDH1A1 (0.62) | KDM4EHPGDNPC1RAB9AMAPT | |
| SCHEMBL1156774 | 0.68 | MAPT (0.54) | KDM4EHPGDNPC1RAB9ACASP3 | |
| SCHEMBL5188877 | 0.68 | CYP1A2 (0.60) | KDM4EHPGDNPC1MAPTSMN1; SMN2 | |
| Ethyl Benzoate SCHEMBL11244230 | 0.68 | LMNA (0.68) | NPC1RAB9AMAPTSMN1; SMN2LMNA | |
| SCHEMBL11277059 | 0.67 | MAP3K5 (0.54) | KDM4EHPGDNPC1RAB9AMAPT |
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-2247588-A2 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009107850-A2 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-09-03 | — | — | WO | disclosed |