Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2R | P25116 | 6/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | DCPS | Q96C86 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6630460 | 0.85 | CYP1A2 (0.38) | F2RCYP1A2CYP3A4CYP2D6ALOX15 | |
| SCHEMBL6630676 | 0.85 | HTT (0.35) | F2RTP53MAPTDCPSHTT | |
| SCHEMBL6630767 | 0.83 | F2R (0.46) | F2RTP53MAPTDCPSHTT | |
| SCHEMBL6630874 | 0.74 | TRPM5 (0.35) | CYP3A4KDM4ECYP2C19MAPTALDH1A1 | |
| SCHEMBL6631095 | 0.73 | DCPS (0.38) | F2RDCPSALDH1A1HTTADORA2A | |
| SCHEMBL35210414 | 0.65 | F2R (1.00) | F2RCYP1A2CYP3A4CYP2D6ALOX15 | |
| SCHEMBL1760395 | 0.65 | F2R (1.00) | F2RCYP1A2CYP3A4CYP2D6ALOX15 | |
| Hydrochloric Acid SCHEMBL17261836 | 0.64 | F2R (0.98) | F2RCYP1A2CYP3A4CYP2D6ALOX15 | |
| SCHEMBL24166733 | 0.63 | F2R (0.73) | F2RCYP1A2CYP3A4CYP2D6ALOX15 | |
| SCHEMBL24164678 | 0.62 | F2R (0.74) | F2RCYP1A2CYP3A4CYP2D6ALOX15 |
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-6740657-B2 | FOR EXAMPLE, N3-CYCLOPROPYL-7-((2,6-DICHLOROPHENYL)METHYL)-9-((DIMETHYLAMINO)METHYL)-7H -PYRROLO(3,2-F) QUINAZOLINE-1,3-DIAMI NE; TREATING CARDIOVASCULAR DISORDERS, RESTENOSIS, THROMBOSIS, AND OTHER DISORDERS | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2004-05-25 | — | — | US | disclosed |