Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | RXRA | P19793 | 2/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8169965 | 0.88 | ESR1 (0.51) | LMNACYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL8179470 | 0.87 | ESR1 (0.45) | LMNACYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL8171257 | 0.84 | PDE5A (0.53) | LMNACYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL8177939 | 0.82 | ESR1 (0.51) | LMNACYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL8170405 | 0.82 | ESR1 (0.52) | LMNACYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL8171050 | 0.81 | KMT2A (0.50) | LMNAMAPTESR1MEN1ALDH1A1 | |
| SCHEMBL8177979 | 0.80 | PDE5A (0.45) | HPGDESR1KDM4EMEN1ALDH1A1 | |
| SCHEMBL8184744 | 0.79 | CA1 (0.49) | LMNACYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL8171015 | 0.79 | ESR1 (0.47) | ESR1PDE4BPDE4DMEN1KMT2A | |
| SCHEMBL8180832 | 0.76 | PDE5A (0.50) | LMNACYP1A2CYP2D6TSHRCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-6130223-A | Thienopyrimidine with phosphodiesterase V inhibiting effect | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-10-10 | — | — | US | disclosed |