Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.37 |
| ▸ | C1S | P09871 | 1/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.37 |
| ▸ | WNT3A | P56704 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31309786 | 0.80 | CTNNB1 (0.58) | TDP1HPGDNPC1RAB9AMAPT | |
| SCHEMBL1210113 | 0.80 | CTNNB1 (0.58) | TDP1HPGDNPC1RAB9AMAPT | |
| SCHEMBL2064455 | 0.78 | NPC1 (0.58) | TDP1ALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL8427325 | 0.77 | TPMT (0.46) | TPMTALDH1A1HCAR1HPGDRAB9A | |
| SCHEMBL13886370 | 0.77 | MEN1 (0.49) | TPMTTAS1R3TAS1R1TDP1CNR2 | |
| SCHEMBL10497616 | 0.77 | KDM4E (0.49) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11974562 | 0.77 | TPMT (0.56) | TPMTTAS1R3TAS1R1TDP1HCAR1 | |
| SCHEMBL30089552 | 0.77 | TPMT (0.56) | TPMTALDH1A1HCAR1HPGDPRSS1 | |
| Dimethylamine SCHEMBL6944970 | 0.77 | KDM4E (0.44) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28874159 | 0.76 | CTNNB1 (0.54) | TDP1HPGDNPC1RAB9AMAPT |
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-5945382-A | AND A METHOD OF THEIR PREPARATION BY CHLORINATION OF AN INTERMEDIATE ARYLPYRAZOLE; PROTECTION AGAINST FUNGAL DISEASES IN TOMATO, RICE, AND WHEAT PLANTS | RHONE-POULENC AGROCHIMIE (FR) | 1999-08-31 | — | — | US | disclosed |