Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.36 |
| ▸ | FNTB | P49356 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 7/20 | 0.36 |
| ▸ | ACHE | P22303 | 7/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8892577 | 0.89 | TACR1 (0.39) | TACR1FNTAFNTBBCHEACHE | |
| SCHEMBL8891902 | 0.84 | SIGMAR1 (0.39) | TACR1TSHRLMNAKMT2A | |
| Bromide SCHEMBL8891355 | 0.83 | ALDH1A1 (0.38) | TACR1FNTAFNTBBCHEACHE | |
| Bromide SCHEMBL8890180 | 0.83 | TACR1 (0.38) | TACR1FNTAFNTBLMNAHCRTR1 | |
| Bromide SCHEMBL8891366 | 0.82 | TACR1 (0.37) | TACR1FNTAFNTBTSHRHCRTR1 | |
| SCHEMBL8892349 | 0.82 | LMNA (0.38) | TSHRLMNAMEN1KMT2A | |
| Iodide SCHEMBL8891218 | 0.82 | TACR1 (0.36) | TACR1FNTAFNTBGRIN2BMEN1 | |
| Bromide SCHEMBL8891352 | 0.81 | TACR1 (0.41) | TACR1FNTAFNTBMEN1KMT2A | |
| Bromide SCHEMBL8890170 | 0.81 | ALDH1A1 (0.37) | TACR1FNTAFNTBBCHEACHE | |
| SCHEMBL8890274 | 0.80 | TACR1 (0.42) | TACR1FNTAFNTBBCHEACHE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997005110-A1 | PERHYDROISOINDOLE DERIVATIVES AS SUBSTANCE P AND NEUROKININE A ANTAGONISTS | RHONE-POULENC RORER S.A. (FR) | 1997-02-13 | — | — | WO | disclosed |