Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23723512 | 0.86 | ALDH1A1 (0.43) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL10272367 | 0.85 | ALDH1A1 (0.48) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL31287485 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL13684202 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL11339370 | 0.81 | ALDH1A1 (0.44) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL4128007 | 0.80 | CES2 (0.43) | ALDH1A1TP53TSHR | |
| SCHEMBL1114942 | 0.80 | HDAC3 (0.44) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL12679952 | 0.80 | ALDH1A1 (0.40) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL1115146 | 0.80 | HDAC3 (0.44) | ALDH1A1TP53TSHRDDB1CRBN | |
| SCHEMBL31606582 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TP53TSHRDDB1CRBN |
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-5512594-A | ADMINISTERING TO TREAT A MEDICAL CONDITION MEDIATED BY ONE OR MORE LEUKOTRIENES | ZENECA LIMITED (GB) | 1996-04-30 | — | — | US | disclosed |
| WO-1994025453-A1 | 4-ARYL-4-HYDROXY-TETRAHYDROPYRANS AND 3-ARYL-3-HYDROXY-TETRAHYDROFURANS AS 5-LIPOXYGENASE INHIBITORS | ZENECA LIMITED (GB) | 1994-11-10 | — | — | WO | disclosed |