Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.76 |
| ▸ | LMNA | P02545 | 4/20 | 0.76 |
| ▸ | ATM | Q13315 | 2/20 | 0.76 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.76 |
| ▸ | CNR1 | P21554 | 1/20 | 0.76 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.76 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22931582 | 1.00 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL30603080 | 1.00 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL4433240 | 1.00 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL4433235 | 1.00 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL11419875 | 0.89 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL9557955 | 0.89 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL11344968 | 0.89 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL11624273 | 0.89 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL523193 | 0.89 | TDP1 (0.76) | TDP1LMNAATMADRA2ACNR1 | |
| SCHEMBL14157372 | 0.88 | TDP1 (0.61) | TDP1LMNAATMADRA2ACNR1 |
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-11119033-B2 | Conformation analysis device, analysis method, conformational notation device and notation method | Izumi, Hiroshi (JP) | 2021-09-14 | — | — | US | disclosed |
| US-20090248321-A1 | Conformation analysis device, analysis method, conformational notation device and notation method | IZUMI, HIROSHI (JP) | 2009-10-01 | — | — | US | disclosed |