Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6153011 | 0.81 | TDP1 (0.46) | TDP1TSHRHPRT1CTSBALDH1A1 | |
| SCHEMBL7088652 | 0.79 | MAPT (0.47) | TDP1TSHRHPRT1CTSBALDH1A1 | |
| SCHEMBL1138440 | 0.76 | TDP1 (0.41) | TDP1TSHRHPRT1CTSBALDH1A1 | |
| SCHEMBL3071001 | 0.71 | CYP2A6 (0.40) | TSHRALDH1A1KDM4EMAPTHTT | |
| SCHEMBL29378223 | 0.71 | TDP1 (0.54) | TDP1TSHRHPRT1CTSBALDH1A1 | |
| SCHEMBL414254 | 0.71 | TDP1 (0.54) | TDP1TSHRHPRT1CTSBALDH1A1 | |
| SCHEMBL4574563 | 0.70 | CYP3A4 (0.55) | TDP1TSHRCTSBALDH1A1MAPT | |
| SCHEMBL249714 | 0.69 | TDP1 (0.52) | TDP1TSHRHPRT1CTSBALDH1A1 | |
| SCHEMBL11609420 | 0.69 | CASP6 (0.44) | TDP1TSHRHPRT1ALDH1A1MAPT | |
| SCHEMBL6245129 | 0.69 | HPRT1 (0.78) | TDP1TSHRHPRT1CTSBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6639070-B1 | 4-substituted 1,3,4-oxadiazines; herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2003-10-28 | — | — | US | disclosed |
| EP-1187819-B1 | N-SUBSTITUTED PERHYDRO DIAZINE | BASF AG (DE) | 2003-07-23 | — | — | EP | disclosed |
| CN-1364161-A | N-substituted perhydrodiazines | BASF AG (DE) | 2002-08-14 | — | — | CN | disclosed |