Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | MLYCD | O95822 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9858671 | 0.82 | TSHR (0.48) | TSHRACHETDP1NPC1RAB9A | |
| SCHEMBL5682958 | 0.80 | — | — | |
| SCHEMBL9163519 | 0.79 | TSHR (0.50) | TSHRACHETDP1ATMNPC1 | |
| SCHEMBL24278474 | 0.78 | RAB9A (0.37) | ACHENPC1RAB9AMAPTCYP19A1 | |
| SCHEMBL9790116 | 0.78 | ESR1 (0.54) | TSHRNPC1RAB9AMAPTCA1 | |
| SCHEMBL24277963 | 0.78 | TGM2 (0.41) | TSHRTGM2ALDH1A1KIF11 | |
| SCHEMBL4969374 | 0.77 | TSHR (0.55) | TSHRACHETDP1ATMNPC1 | |
| SCHEMBL737574 | 0.77 | MAPK1 (0.44) | TSHRMAPTALDH1A1 | |
| SCHEMBL2247665 | 0.76 | TSHR (0.48) | TSHRACHETDP1ATMNPC1 | |
| SCHEMBL23747059 | 0.73 | KIF11 (0.41) | TSHRNPC1RAB9AMAPTCYP19A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0291849-B1 | 4-METHYL-4-PHENYL-PENTAN-1-ALS, THEIR PREPARATION AND APPLICATION AS AROMA CHEMICALS | BASF Aktiengesellschaft (DE) | 1991-10-16 | — | — | EP | disclosed |
| EP-0219092-B1 | PROCESS FOR PREPARING ALKENYLAROMATIC COMPOUNDS | BASF Aktiengesellschaft (DE) | 1989-10-04 | — | — | EP | disclosed |
| US-4837201-A | 4-Methyl-4-phenyl-1-pentanals, their preparation and their use as scents | BASF AKTIENGESELLSCHAFT (DE) | 1989-06-06 | — | — | US | disclosed |
| EP-0291849-A2 | 4-Methyl-4-phenyl-pentan-1-als, their preparation and application as aroma chemicals | BASF Aktiengesellschaft (DE) | 1988-11-23 | — | — | EP | disclosed |
| US-4709109-A | Preparation of alkenylaromatics | BASF AKTIENGESELLSCHAFT (DE) | 1987-11-24 | — | — | US | disclosed |