Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6963319 | 1.00 | ALDH1A1 (0.45) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL14449261 | 0.81 | MAPT (0.40) | MAPTHPGDCYP3A4HSD17B1HSD17B2 | |
| SCHEMBL6962886 | 0.78 | TUBB4A (0.43) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL6962880 | 0.78 | TUBB4A (0.43) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL14691163 | 0.77 | MAPT (0.58) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL14449260 | 0.77 | TTR (0.42) | ALDH1A1MAPTNPC1RAB9ACYP3A4 | |
| SCHEMBL14016167 | 0.77 | TTR (0.42) | NPC1RAB9ACYP3A4CYP1A2CYP2D6 | |
| SCHEMBL6958908 | 0.76 | ALDH1A1 (0.49) | ALDH1A1MAPTHPGDKDM4ENPC1 | |
| SCHEMBL11815106 | 0.72 | MAOB (0.64) | MAPTCYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL11815111 | 0.72 | MAOB (0.64) | MAPTCYP3A4CYP1A2CYP2D6CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0974584-B1 | FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-01-15 | — | — | EP | disclosed |
| US-6420375-B1 | ANTITUMOR | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-07-16 | — | — | US | disclosed |
| EP-0974584-A1 | FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2000-01-26 | — | — | EP | disclosed |