Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL11131577 | 0.80 | CYP1A2 (0.50) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL19407799 | 0.77 | L3MBTL1 (0.52) | RAB9AMAPTL3MBTL1POLB | |
| SCHEMBL15839257 | 0.76 | L3MBTL1 (0.47) | CYP1A2CYP2C9CYP2C19ACHELMNA | |
| SCHEMBL15788684 | 0.76 | CYP1A2 (0.42) | CYP1A2CYP2C9CYP2C19S1PR1BCHE | |
| SCHEMBL18464138 | 0.74 | CYP1A2 (0.47) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL10269779 | 0.73 | THRA (0.48) | CYP1A2CYP2C9CYP2C19THRBTHRA | |
| SCHEMBL2033249 | 0.72 | CYP1A2 (0.45) | CYP1A2CYP2C9CYP2C19THRBTHRA | |
| SCHEMBL7739532 | 0.72 | CYP1A2 (0.45) | CYP1A2CYP2C9CYP2C19THRBTHRA | |
| SCHEMBL29622968 | 0.72 | CYP1A2 (0.45) | CYP1A2CYP2C9CYP2C19THRBTHRA | |
| SCHEMBL23915467 | 0.72 | MAPT (0.48) | THRBMEN1KMT2ALMNANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0710257-A1 | IMIDO TRANSITION METAL COMPLEX METATHESIS CATALYSTS | SHELL OIL CO (US) | 1996-05-08 | — | — | EP | disclosed |
| WO-1995003346-A1 | IMIDO TRANSITION METAL COMPLEX METATHESIS CATALYSTS | SHELL OIL COMPANY (US) | 1995-02-02 | — | — | WO | disclosed |