Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9299317 | 0.91 | ALDH1A1 (0.51) | ALDH1A1HTTPKMKDM4ERAB9A | |
| SCHEMBL8510873 | 0.86 | RAB9A (0.50) | ALDH1A1RAB9ASMN1; SMN2ATMNPC1 | |
| SCHEMBL8510870 | 0.86 | ALDH1A1 (0.49) | ALDH1A1RAB9AMAPTLMNASMN1; SMN2 | |
| SCHEMBL9300025 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HTTPKMKDM4ERAB9A | |
| SCHEMBL27951862 | 0.83 | ALDH1A1 (0.51) | ALDH1A1HTTPKMKDM4ERAB9A | |
| SCHEMBL28158074 | 0.83 | ALDH1A1 (0.49) | ALDH1A1HTTPKMKDM4ERAB9A | |
| SCHEMBL84134 | 0.82 | ALDH1A1 (0.49) | ALDH1A1HTTRAB9AMAPTLMNA | |
| SCHEMBL11790891 | 0.80 | ALDH1A1 (0.48) | ALDH1A1HTTRAB9AMAPTLMNA | |
| SCHEMBL7560433 | 0.80 | ALDH1A1 (0.46) | ALDH1A1HTTPKMKDM4ERAB9A | |
| SCHEMBL8435360 | 0.80 | RAB9A (0.48) | ALDH1A1RAB9AMAPTSMN1; SMN2ATM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5280027-A | Quinazoline containing compound | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-01-18 | — | — | US | disclosed |
| EP-0459730-A2 | Anti-tumour compounds | ZENECA LIMITED (GB) | 1991-12-04 | — | — | EP | disclosed |