Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.43 |
| ▸ | UBE2M | P61081 | 1/20 | 0.42 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL3689303 | 0.83 | KDM4E (0.49) | NPY5RALDH1A1KDM4EUBE2MDCUN1D1 | |
| SCHEMBL3691553 | 0.82 | KDM1A (0.45) | ALDH1A1TSHRUSP2UBE2MDCUN1D1 | |
| SCHEMBL5650842 | 0.79 | NPY5R (0.45) | NPY5RALDH1A1TSHRKDM4ECXCR4 | |
| SCHEMBL13145817 | 0.79 | ALDH1A1 (0.47) | NPY5RALDH1A1TSHRKDM4ECXCR4 | |
| SCHEMBL5651328 | 0.75 | ALKBH5 (0.48) | ALDH1A1TSHRUSP2KDM4EHPGD | |
| SCHEMBL3688187 | 0.74 | CYP2D6 (0.47) | ALDH1A1KDM4ERAB9AMEN1KMT2A | |
| SCHEMBL3691277 | 0.73 | MEN1 (0.39) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL14514796 | 0.72 | HTR6 (0.49) | NPY5RALDH1A1KDM4EPOLBLMNA | |
| SCHEMBL5651335 | 0.72 | ALKBH5 (0.48) | ALDH1A1TSHRUSP2KDM4EHPGD | |
| SCHEMBL5316579 | 0.71 | NPY5R (0.47) | NPY5RALDH1A1KDM4ECXCR4POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2239260-A1 | Novel compounds with antibacterial activity | Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) | 2010-10-13 | — | — | EP | disclosed |