Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | UBE2M | P61081 | 1/20 | 0.45 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | EDNRA | P25101 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30099061 | 0.79 | NOTUM (0.47) | ALDH1A1KDM4EMAPT | |
| SCHEMBL19953512 | 0.76 | UBE2M (0.43) | ALDH1A1UBE2MDCUN1D1MEN1KMT2A | |
| SCHEMBL9028941 | 0.75 | KDM4E (0.40) | ALDH1A1HPGDBRD4KDM4EMAPT | |
| SCHEMBL12889717 | 0.75 | BRD4 (0.45) | ALDH1A1UBE2MDCUN1D1MEN1KMT2A | |
| SCHEMBL19312323 | 0.75 | BRD4 (0.45) | ALDH1A1UBE2MDCUN1D1MEN1KMT2A | |
| SCHEMBL30241212 | 0.75 | HDAC3 (0.42) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL2597682 | 0.72 | ALDH1A1 (0.53) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL28850201 | 0.72 | ALDH1A1 (0.53) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL916737 | 0.72 | ALDH1A1 (0.53) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL11922115 | 0.71 | BRD4 (0.42) | ALDH1A1POLBUBE2MDCUN1D1MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |