Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CD44 | P16070 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 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 | |
|---|---|---|---|---|
| SCHEMBL22450152 | 0.87 | CYP3A4 (0.62) | ALDH1A1CYP3A4TSHRTDP1TP53 | |
| SCHEMBL3699879 | 0.87 | ALDH1A1 (0.39) | ALDH1A1CYP3A4TSHRTDP1TP53 | |
| SCHEMBL2026463 | 0.82 | CA1 (0.50) | ALDH1A1SRCMYCCA1CA2 | |
| SCHEMBL5011792 | 0.80 | HEXA (0.40) | ALDH1A1CYP3A4TSHRCD44SRC | |
| SCHEMBL3689049 | 0.80 | DHFR (0.38) | ALDH1A1CYP3A4TSHRCD44SRC | |
| SCHEMBL10987129 | 0.77 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRTDP1TP53 | |
| SCHEMBL30978224 | 0.75 | CA12 (0.49) | ALDH1A1CYP3A4TSHRTDP1TP53 | |
| SCHEMBL22517355 | 0.75 | CA12 (0.49) | ALDH1A1CYP3A4TSHRTDP1TP53 | |
| SCHEMBL3355657 | 0.74 | ENPP1 (0.42) | TDP1RAB9AMYCCA1CA2 | |
| SCHEMBL23854309 | 0.73 | CA1 (0.45) | ALDH1A1CYP3A4TSHRTDP1CD44 |
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-7741240-B2 | Transition metal compounds for olefin polymerization and oligomerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2010-06-22 | — | — | US | disclosed |
| US-20080033125-A1 | Transition Metal Compounds for Olefin Polymerization and Oligomerization | EXXONMOBIL CHEMICAL PATENTS INC. | 2008-02-07 | — | — | US | disclosed |